ML20086A653
| ML20086A653 | |
| Person / Time | |
|---|---|
| Site: | Wolf Creek  |
| Issue date: | 05/03/1995 |
| From: | Freeman W, Keller T NUCON, INC. |
| To: | |
| Shared Package | |
| ML20086A652 | List: |
| References | |
| NUDOCS 9507030332 | |
| Download: ML20086A653 (61) | |
Text
,
NUCON Internotional, Inc. -
VELEPHONE: i6141846-5710 OUTSIDE OHlO. 1-600-992 5192 P.O. BOX 29151 7000 HUNTLEY ROAD TELEX: 6374415 COLUMBUS. OHIO 43229 U.S.A. ,~ FAX: (614) 431 4 858
, PYROLYSIS GAS CIIROhfATOGRAPIW ANALYSIS OF 5 THERh10-LAG FIRE BARRIER SAhfPLES Performed For:
Wolf Creek Nuclear Operating Corp.
1550 Oxen Lane N. E. ,
P.O. Box 411 Burlington, KS 66839 P.O. No. 563516 17 April 1995 Djstribution WCNOC: Afike Hancock NEI: Biff Bradley NUCON: 06WC814 hiaster File (1)
Lab (1) 9 NUCON 06WC814/01 9507030332 950627 PDR ADDCK 05000402 P PDR 1
,- . NUCON 06WC814/01 NUCON Internotional, Inc. TELEPHONE: 4614) 845-5710 OUTSIDE OHIO: 1-800-992-5192 P.O BOX 29151 7000 HUNTLEY ROAD TELEX: 6974415 COLUMBUS. OHIO 43229 U.S.A. , FAX: (614) 431-0858 W Prepared By Reviewed By Original Issue .
mm - (t W. P. Freeman T. Af Keller Date 6 Date J }Y l
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NUCON 06WC814/01 ;
ll 1
L I. ABSTRACT -
l Inspection of the pyrograms of 5 Thermo-Lag fire barrier samples indicated that they are i all similar in chemical composition. l II. OBJECTIVE -
Pyrolysis Gas Chromatography (PGC) with Mass Selective Detection (MSD) was used to qualitatively compare five Thermo-Lag fire barrier samples.
III. DESCRIPTION OF METHOD The samples were compared by pyrolysis gas chromatography using ASTM D3452 as a general guide. A Hewlett-Packard model 5890 series II gas chromatograph equipped
]l with a Hewlett Packard model 5972 mass selective detector was used to generate chromatograms of the pyrolysis products. Pyrolysis of the Thermo-Lag samples were l performed with a CDS pyroprobe mounted in an independently heated interface attached to the injection port of the GC. Analysis involves weighing 1-3 mgs. of sample in'a quartz tube and placement of the tube in the platinum coil element of the probe. The j probe is then placed in the interface and pyrolysed ballistically for 2 seconds. , Pyrolytic ;
products are then swept by the carrier gas onto the fused silica capillary column where j they are separated and detected with a MSD. Chromatographic and pyrolysis conditions l are shown in Table 1. Prior to each analysis, the column is heated to 250*C to elute any i volatiles which were not entrained in the polymer.
IV. PRESENTATION OF RESULTS The five pyrograms for each of the nine Thermo-Lag samples are shown in Figures 1, j 3, 5, 7, 9. Figures 2, 4, 6, 8,10 are extracted ion chromatograms using the acrylate 'l base ion m/e of 55 common to ethyl acrylate (EA) and a m/e of 69 common to methyl j methacrylate (MMA). The area ratios of these two peaks are shown in Table 2 for each a sample. Following these two figures is attached a library search which identifies some i of the major peaks for each sample tested and a summary area percent report. l i
V. DISCUSSION OF RESULTS !
I q
The area ratio of EA/MMA shown in Table 2 on the average (1.35) are consistent with ;
the ratios obtained from other Thermo-Lag compounds'(1.4), though the variability of 0.2 (la) is twice that expected (0.1 for 1 a). The samples that contribute to this wider .
variance are 0395-108, C and D. For sample 0395-10B, a 3 hour3.472222e-5 days <br />8.333333e-4 hours <br />4.960317e-6 weeks <br />1.1415e-6 months <br /> rated panel sample,'
J a wider variance has been found for this subset of sample types and this value falls 1
,; :f; -
NUCON 06WC814/01. ,
c ,
within the expected range (1.4 i 0.3, i 2 a).-. We also find identified in this sample's pyrogram the 3 methyl; 3,5-dimethyl, 5-ethenyl-2-methyl pyridine compounds along with the triphenyl ester of phosphoric acid, octicizer, 2-phenoxy ethanol and the diethyl ester of pentanedioic acid typical as pyrolysis products of Thermo-Lag.
' For sample 0395-10C, the EA/MMA ratio is within 3 a of the expected value (1.4 i 0.3) while also identified in the pyrogram are the 2,5-dimethyl; 3,5-dimethyl; trimethyl pyridine compounds along with 2-phenoxy ethanol, diethyl ester of pentanedioic acid and octicizer consistent as pyrolysis products of Thermo-Lag.
For sample 0395-10D, the EA/MMA ratio is within 2 a of the expected value (1.4 i.
0.2). In addition, the expected pyridine compounds, phosphoric acid esters, and phenoxy ethanol are present, consistent with pyrolysis products of Thermo-Lag.
In conclusion, inspection of the pyrograms of these five Thermo-Lag sample indicate that they are consistent in terms of chemical composition.
2
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- j. '*
. ~ NUCON 06WC814/01 TABLE 1 Chrontatographie Conditions:
30 meter 0.25 mm narrow bore fused silica HP-5 CB capillary column.
Carrier Gas: Helium,0.9 mumin, split ratio 35:1 Column Conditions:
Initial Temperature: 50*C for 1 minute hold Temperature Ramp: 8*C/ min to 250'C Final Temperature: Hold at 250*C for 10 minutes Injector Temperature: 250*C Detector Temperature: 280*C Detector was an HP MSD in scan mode (30-550 amu)
Pyrolysis Conditions:
Pyrolysis Temperature: 650*C Interval: 2 seconds Ramp: 2*C/ millisecond Probe Type: Platinum Coil -
Interface Temperature: 205'C d
NUCON 06WC814/01 ,
TABLE 2 Sample EA/MMA Ratio NUCON Lab Log # 0395-10A 1.36 3 hour3.472222e-5 days <br />8.333333e-4 hours <br />4.960317e-6 weeks <br />1.1415e-6 months <br /> conduit, area A-33, IU1041 NUCON Lab Log # 0395-10B 1.17 3 hour3.472222e-5 days <br />8.333333e-4 hours <br />4.960317e-6 weeks <br />1.1415e-6 months <br /> panel, area A-33, J-Box between IU1039 & IU1037 NUCON 12b Log # 0395-10C 1.67 1 hour1.157407e-5 days <br />2.777778e-4 hours <br />1.653439e-6 weeks <br />3.805e-7 months <br /> conduit, warehouse Lot # 40180 NUCON Lab Log # 0395-10D 1.15 1 hour1.157407e-5 days <br />2.777778e-4 hours <br />1.653439e-6 weeks <br />3.805e-7 months <br /> panel, warehouse Lot #64659 NUCON Lab Log # 0395-10E 1.40 Trowel grade, area A-33 Between IU1037 & IU1040 Average 1.35 i 0.2 i
4
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File : C:\HPCHEM\1\ DATA \EM31489A.D i Operator : Marti .
Acquired : 13 Mar'95 2:47 pm using AcqMethod EM31492 Instrument : 5972 - 33 -'
Sample Name: 0395-10a .
Misc Info : Pyrolysis of thermolag samples !
Vial Number: 1 i FIGURE 1 Abundance TIC: EM31459A.D
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i File : C:\HPCHEM\1\ DATA \EM31489A.D Operator : Marti ,
Acquired- : 13 Mar 95 2:47 pm using AcqMethod EM31492 '
Instrument-:
5972 - 33 -
Sample Name: 0395-10a
- Misc Info : Pyrolysis of thermolag samples Vial Number: 1 i FIGURE 2 Xbundance Ion 55.00 (54.70 to 55.70) : EM31489A.D 2.!86 I l 400000: {
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Aouncance Ion 69.00 (65.70 to 69.70): EM31489A.D 400000I '
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- File : C:\HPCHEM\1\ DATA \EM31489A.D .,
Operator : Marti. l
- Acquired
- ' 13 Mar 95 . 2:47.pm-using AcqMethod EM31492 !
SCmple Name: 0395-10a .
l Misc Info : Pyrolysis of--thermolag samples l Vial Number: 1 .'
Scarch Libraries: C:\ DATABASE \NBS75K.L Minimum Quality: 0 Unknown Spectrum: Apex Integration Params: AutoIntegrate Pk# RT Areat Library /ID Ref# CAS# Qual 1 1.71 40.72 C:\ DATABASE \NBS75K.L No matches found 2 2.30 2.30 C:\ DATABASE \NBS75K.L Furan, 2-methyl- 463 000534-22-5 81 Furan, 2-methyl- 62665 000534-22-5 64 Furan, 2-methyl- 62666 000534-22-5 59 3 2.71 0.37 C:\ DATABASE \NBS75K.L Furan, 2-methyl- 463 000534-22-5 76 ;
Furan, 2-methyl- 62665 000534-22-5 70 y Furan, 2-methyl- 62666 000534-22-5 53 4 2.86 1.64 C:\ DATABASE \NBS75K.L 2-Propenoic acid, ethyl ester 63318 000140-88-5 91 2-Propenoic. acid, ethyl ester 63320 000140-88-5 87 <
Propenoic acid, ethyl ester 63319 000140-88-5 83 l
5 2.98 5.50 C:\ DATABASE \NBS75K.L 2-Propenoic acid, 2-methyl , 3-hyd 8333 002761-09-3 72 i 2-Propenoic' acid, 2-methyl , methy 63329 000080-62-6 58 2-Propenoic acid, 2-methyl , methy 63330 000080-62-6 52 ,
6 3.52 1.64 C:\ DATABASE \NBS75K.L 1-Decyne 7027 000764-93-2 43 1H-Pyrrole, 1-methyl- 62654 000096-54-8 38 1H-Pyrrole, 1-methyl- 446 000096-54-8 38 L
7 5.03 4.68 C:\ DATABASE \NBS75K.L Pyridine, 3-methyl- 63044.000108-99-6 97 Pyridine, 3-methyl- 981 000108-99-6 95 ;
Pyridine, 3-methyl- 63045 000108-99-6 95 ;
8 6.30 0.45 C:\ DATABASE \NBS75K.L Pyridine, 2,5-dimethyl- 2046 000589-93-5 95- .
Pyridine, 2,5-dimethyl- 63719 000589-93-5 93 i Pyridine, 2,3-dimethyl- 63734 000583-61-9 92 9 6.83 0.36 C:\ DATABASE \NBS75K.L Pyridine, 3-ethyl- 63740 000536-78-7 96 Pyridine, 2,5-dimethyl- 2046 000589-93-5 91 Pyridine, 3-ethyl- 2055 000536-78-7 81 C:\HPCHEM\1\ DATA \EM31489A.D Mon Mar 13 15:24:29 1995 Page 1
. Pk#.,RT Aract Librcry/ID . Raf# CAS# Quni 10 6.95 0.37 C:\ DATABASE \NBS75K.L Pyridine, 3-ethenyl- 1970 001121-55-7 76 Pyridine, 2-ethenyl- 1972 000100-69-6 58 Pyridine, 4-ethenyl- 1971 000100-43-6 52
~
11 7.12 1.98 C:\ DATABASE \NBS75K.L Pyridine, 3,5-dimethyl- 2047 000591-22-0 95 Pyridine, 3,4-dimethyl- 2050 000583-58-4 95 Pyridine, 3,5-dimethyl- 63720 000591-22-0 91 12 7.37 0.55 C:\ DATABASE \NBS75K.L Pyridine, 4-ethyl- 63729 000536-75-4 38 Pyridine, 4-ethyl- 63730 000536-75-4 38 Pyridine, 4-ethyl- 2051 000536-75-4 38 13 7.85 0.58 C:\ DATABASE \NBS75K.L Pyridine, 2-ethyl-6-methyl- 3834 001122-69-6 43 Benzenamine, N-(1-methylethyl)- 6310 000768-52-5 35 1H-Pyrrole-2-acetonitrile, 1-methy 3744 024437-41-0 35 14 8.65 1.11 C:\ DATABASE \NBS75K.L Pyridine, 2,3,6-trimethyl- 3822 001462-84-6 60 Pyridine, 2,3,5-trimethyl- 3839 000695-98-7 60 Benzenamine, 3,5-dimethyl- 3837 000108-69-O'46 15 8.93 0.74 C:\ DATABASE \NBS75K.L Pyridine, 3-ethyl-5-methyl- 3821 003999-78-8 93 Pyridine, 5-ethyl-2-methyl- 64621 000104-90-5 64 Aniline, 2-ethyl- 64597 000587-02-0 60 16 9.11 0.98 C:\ DATABASE \NBS75K.L Pyridine, 5-ethenyl-2-methyl- 3656 000140-76-1 93 Benzoic acid, 2,5-dimethyl , (2,4- 37433 055000-48-1 42 Benzene, 1-methyl (1-methylethyl 65535 000099-87-6 38 17 9.33 5.13 C:\ DATABASE \NBS75K.L Benzenamine, 4-propoxy- 10015 004469-80-1 59 Phenol, 4-amino- 2211 000123-30-8 52 Nerinine 48936 000481-44-7 50 18 9.91 1.14 C:\ DATABASE \NBS75K.L 1H-Pyrrole, 2,3,4,5-tetramethyl- 4056 001003-90-3 87 Borane, ethylbis(2,3,4,5-tetrameth 40184 028916-15-6 56 5-Dimethylaminopyrimidine 4021 031401-46-4 38 19 10.15 0.39 C:\ DATABASE \NBS75K.L Quinoline, 1,2,3,4-tetrahydro- 65454 000635-46-1 38 Quinoline, 5,6,7,8-tetrahydro- 6001 010500-57-9 30 Thiourea, tetramethyl- 5727 002782-91-4 27-20 11.09 1.80 C:\ DATABASE \NBS75K.L 1H-Pyrrole, 3-ethyl-2,5-dimethyl- 4061 069687-78-1 58 1H-Pyrrole, 2-ethyl-3,5-dimethyl- 4057 032990-59-3 52 1H-Pyrrole, 3-ethyl-2,4-dimethyl- 64742 000517-22-6 52 C:\HPCHEM\1\ DATA \EM31489A.D Mon Mar 13 15:24:51 1995 Page 2
s
, Pk#., RT
, Aract LibrCry/ID -
R3f# CAS# Quel 21 11.98 0.54 C:\ DATABASE \NBS75K.L Pentanedioic acid, 2-methyl , mono 12301 072088-36-9 32 ,
Dimethyl ethylbutane-1,4-dioate' 16107 000000-00-0 16 6-Heptenoic acid, 3-oxo , methyl e, 11390 030414-57-4 15 22 12.58 0.82 C:\ DATABASE \NBS75K.L Pentanedioic acid, diethyl ester 19778 000818-38-2 81 Pentanedioic acid, diethyl ester 69155 000818-38-2 58 Pentanedioic acid, diethyl ester 69156 000818-38-2 53 23 13.45 2.17 C:\ DATABASE \NBS75K.L Piperidine, 1-methyl- 63293 000626-67-5 38 3-Ethoxy-2-methyl-2-cyclohexen-1-o 10788 020643-20-3 35 Piperidine, 1-(ethoxymethyl)- 8191 003275-13-6 30 i 24 16.03 2.22 C:\ DATABASE \NBS75K.L Hydra zine , 1,1 -dime t hyl (1 -me thy 5486 075267-97-9 38 Butanamide, 3-methyl- 1621 000541-46-8 38 Pentanamide, 4-methyl- 3136 001119-29-5 38 25 16.38 1.27 C:\ DATABASE \NBS75K.L Ethanol, 2-(2-phenoxyethoxy)- 18349 000104-68-7 46 Butanamide 62880 000541-35-5 30 1-Propanol, 3 - [3 - (1-methylethoxy) p 16653 054518-03-5 27 26 17.75 0.57 C:\ DATABASE \NBS75K.L Phenol, 4-(1,1,3,3-tetramethylbuty 24424 000140-66-9 93 Phenol, 4 - (2,2,4 -trimethylpentyl) - 24397 000000-00-0 64 Phenol, 4- (1,1,3,3-tetramethylbuty 70047 000140-66-9 52 27 18.3.5 1.09 C:\ DATABASE \NBS75K.L 2,5,8,11,14-Pentaoxapentadecane 70592 000143-24-8 47 1-Propanol, 2-(2-hydroxypropoxy)- 6086 000106-62-7 47 2 - Propanol , 1- [1-methyl ( 2 -prope 16196 055956-25-7 43 28 18.49 0.92 C:\ DATABASE \NBS75K.L 2 -Propanol, 1- [2 - (2 -methoxy-1-me th 24251 020324-33-8 38 2,5,8,11,14,17-Hexaoxaoctadecane 36869 001191-87-3 38 1-Propanol, 2- (2-hydroxypropoxy) - 6086 000106-62-7 38 29 19.11 0.34 C:\ DATABASE \NBS75K.L Diazene, [1- (2,2-dimethylhydrazino 15672 061940-94-1 43 Pentanamide 1620 000626-97-1 38 Butanamide 62880 000541-35-5 38 30 19.93 0.95 C:\ DATABASE \NBS75K.L Benzo [b] thiophene, 2-(butylthio)- 28074 054965-46-7 20 7, 8 -Dihydro- 2 -methyl ( 6H) pyrazolo [ 3 27965 000000-00-0 16 Flavone 70612 000525-82-6 11' 31 20.27 1.30 C:\ DATABASE \NBS75K.L Phenol, 2- (2-quinoxalinyl) - 28139 017392-20-0 35 Benzo [b] thiophene, 2 - (butylthio) - 28074 054965-46-7 22 3,5-Dimethoxybenzylamine 14279 034967-24-3 20 C:\HPCHEM\1\ DATA \EM31489A.D Mon Mar 13 15:25:20 1995 Page 3
1
)
,_.Pk#, RT
, Aroc% Librcry/ID . RQf# CAS# QuS1 32 20.44 0.21 C:\ DATABASE \NBS75K.L Nonadecane, 2,3-dimethyl- 42198 075163-99-4 46 Hexadecane . 70788 000544-76-3 46 Tetradecane 69661 000629-59-4 46 33 20.89 0.91 C:\ DATABASE \NBS75K.L 4-Butyloxy-2-hydroxybenzamidine 24821 000000-00-0 20 Pyridine, 2,6-diethyl- 6323 000933-28-4 18 2-Ethyl-3,5-dimethylpyridine 6325 001123-96-2 14 34 21.16 0.73 C:\ DATABASE \NBS75K.L 1,2,4-Benzenetricarboxylic acid 25229 000528-44-9 16 4-Amino-2-methyl-5,6-trimethylenep 9460 076881-49-7 15 2-Propenoic acid, 3-(4-fluoropheny 21199 087087-42-1 11 35 21.49 0.16 C:\ DATABASE \NBS75K.L l ' H- Andros t eno [17,16 -g] indol- 3 54335 056196-20-4 22 l l'H-Androst-16-eno[17,16-b] indol-3 54336 039987-70-7 12 ,
12,13-Dihydro-12-methyl-13,14-diox 46505 059050-19-0 12 !
36 21.78 0.27 C:\ DATABASE \NBS75K.L Pyrido [3,2-d] pyrimidine-2,4 (1H,3H) 24033 016953-81-4 50 5, 9-Methanobenzocycloocten-5 (1H) -o 38886 016004-84-5 49-5,9-Methanobenzocycloocten-4 (1H) -o 38853 006244-16-2 47 )
37 21.90 0.48 C:\ DATABASE \NBS75K.L 2 - Propanol , 1 - [1-methyl ( 2 -prope 68438 055956-2f-7 50 !
Butanamide, 3-methyl- 1621 000541-46-8 46 '
Butane, 2-methoxy- 854 006795-87-5 43 38 22.08 6.08 C:\ DATABASE \NBS75K.L 2-Propanol, 1-[1-methyl-2-(2-prope 68438 055956-25-7 47 1-Propanol, 2- (2-methoxypropoxy) - 9232 013588-28-8 43 Propanoic acid, 2-hydroxy-2-methyl 3494 002110-78-3 43 39 22.79 0.67 C:\ DATABASE \NBS75K.L Butanamide, 3-methyl- 1621 000541-46-8 47 1-Propanol, 2- (2-hydroxypropoxy) - 6086 000106-62-7 35 2-Propanol, 1,l'-[(1-methyl-1,2-et 20630 001638-16-0 35 40 26.25 2.00 C:\ DATABASE \NBS75K.L 7-Amino-2,3-dihydro-5-phenyl-1H-1, 34112 004928-02-3 53 Octicizer 50542 001241-94-7 45 2 - ( 4 - Cyanophenyl ) dime thyl aminom 34091 000000-00-0 42 41 26.53 0.20 C:\ DATABASE \NBS75K.L 4-Methyl-2,6-dihydroxyquinoline 16455 034982-01-9 28 42 27.86 3.34 C:\ DATABASE \NBS75K.L -
Octicizer 50542 001241-94-7 93 7-Amino-2,3-dihydro-5-phenyl-1H-1, 34112 004928-02-3 59 2 - ( 4 - Cyanophe nyl ) dime thylaminom 34091 000000-00-0 45 43 28.10 0.34 C:\ DATABASE \NBS75K.L 4 H- Pyrido [1, 2 - a] pyrimidine a ce t i 33437 050609-61-5 28 C:\HPCHEM\1\ DATA \EM31489A.D Mon Mar 13 15:25:56 1995 Page 4
~
3.;7 .. 'l I
L Areai Percent: Report -- Sorted by Signal ..
_. , lI'
'Information'from Data-File.
! File _ : C:\HPCHEM\1\ DATA \EM31489A.D '
' Operator' :-Marti' . _ . i 1 Acquired. : 13 Mar 95' 2:47 pm using AcqMethod EM31492 l
~hSCmple Name: _0395-10a !
MisciInfo : Pyrolysis of thermolag samples j
- Vial Number:'1 .!
j CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M l
. Retention Time Area i Area % Ratio %.
i Total Ion Chromatogram :
1.707 769309602' 40.719 100.000
2.301 43462737 2.300 5.650 2.702 6959161- 0.368 0.905-2.862 30992515- 1.640 4.029 5 2.986 103922485 5.501 13.509 '
3.516 30912999 1.636 4.018 i 5.036 88434259- 4.681 11.495' !
6.301 6.829 8487128 6763728 0.449 0.358-1.'103-0.879
]
i 6.958 6903203 0.365- 0.897 l 7.123 37468330 '1.983- 4.870 ,
1 7.368 10428535- 0.552 1.356 -l
- . 7.849 '10905475 0.577 1.418- !
8.643 '21065510 - 1.115 2.738 I 8.937. 13944651 -0.738 1.813 ;
9.118 18608914 0.985 2.419 _j 9.330 -96955532 5.132- 12.603 :
9;916 21592353 1.143 2.807- l 10.155 7439902 0.394 0.967! l 111.098 33974681' 1.798 4.416 l 11.976 10236720 0.542 1.331 1 12.579 15437849 0.817 2.007 j 13.459 41030977 2.172 : 5.333- ;
16.037 41881782. 2.217 5.444 :t 16.377 24058192 1.273 3.127. ~1 17.749 10687373 0.566 1.389 !
18.351 20616346 1.091 2.680 18.493 17397737 0.921 2.261 !
c19.109' 6456286 0.342 0.839- l 19.934 17888526 0.947 2.325 -
'i 20.265; 24503626 1.297 3.185 i 20.441 3997301 0.212 0.520- l 20.892 17269000 0.914 2.245 ;
21.161 13726525 0.727 1.784 6 21.498 3007919 0.159 0.391 :
i
-C:\HPCHEM\1\ DATA \EM31489A.D Wed Mar 22 13:36:54 1995 Page 1 l i
l i
i Area Percent Report -- Sorted by Signal '
Information from Data File: ,
. File : C:\HPCHEM\1\ DATA \EM31489A.D ;
Operator .: Marti ;
Acquired : '13 Mar 95 ~2:47 pm using AcqMethod EM31492 ;
S;mple-Name:'0395-10a Misc Info : Pyrolysis of thermolag samples Vial Number: 1-l CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M
' Retention Time Area Arec % Ratio %
i 21.776 5040608 0.267 0.655 21.900 9012.487 0.477 1.171 '
22.084 114820481 6.077 14.925 22.792 12738960 0.674 1.656 t 26.255 37725863 1.997 4.904 ,
26.525 3686067 0.195 0.479 27.860 63169230 3.344 8.211 28.097 6382697 0.338 0.830 t l
l l
C:\HPCHEM\1\ DATA \EM31489A.D Wed Mar 22 13:36:55 1995 Page 2
n Area Percent ~ Report -- Sorted by Signal Information from Data File:
- File : C:\HPCHEM\1\ DATA \EM31489A.D operator : Marti Acquired : 13 Mar 95 2:47 pm using AcqMethod EM31492
!. Srmple Name: 0395-10a
! Misc Info : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M l
Retention Time Area Area % Ratio % i 55.00 amu 2.859 21980583 100.000 100.000 69.00 amu 2.986 16163375 100.000 100.000 I
C:\HPCHEM\1\ DATA \EM31489A.D Wed Mar 22 13:37:38 1995 Page 1
File : C:\HPCHEM\1\ DATA \EM31489B.D Operator : Marti
- Acquired : 13 Mar 95 4:24 pm using AcqMetliod EM31492 Instrument-: 5972 - 33 -
Sample Name: 0395-10b .
Misc Info : Pyrolysis of thermolag samples Vial Number: 1 FIGURE 3 Aouncance tic: EM314898.0
- 7000000g g
! l i 6500000. l 6000000_
5500000_ 1 i
l 5000000-4500000-4000000.
3500000_
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} } $a N) '^ '
' e
- gig ,ldi ;,ep,4lI,^4 g ,g l 0
. Time--> 5.'00 10.00 15.00 20.00 25.00 30.00
+
- i 7 ,._
. File : C:\HPCHEM\1\ DATA \EM31489B.D {
Operator : Marti '
Acquired : 13 Mar 95 4:24 pm using AcqMethod EM31492
. Instrument : 5972 - 33 .,
Sample Name: 0395-10b - -
Misc Info : Pyrolysis of thermolag samples !
Vial Number: 1 i FIGURE 4 Acundance Ion 55.00 (54.70 to 55.70) : EM3T4T9s .D 350000_ 2.'87 f
i 300000_ l h
i >
i i
250000-i ;
200000_ l i
t 150000- !
i I
100000-3.99 50000 - 3.87 3.45 g4.13 5573 0 ' i Time-->
i 1.'00 2.'00 3.00 4.00 5.'00 I X5UHdance Ion 69.00 (68.70 to 69.70): EM314598.D -
350000-300000- 3.00 .
1 I
250000_ J i
200000- .
1 150000_ l
'i 100000_ lI1 - l j i 50000 , ,
t 2.36 ? '.
! O AA J E ---
- Time--> 1.00 2.00 3.00 4.00 5.00
.Infarmation from D ta Filo:
g 'Filb' : C:\HPCHEM\1\ DATA \EM314898.D .
Operatcr : Marti Acquired : '13 Mar 95 4:24 pm using AcqMethod EM31492 Sample Name: 0395-10b Misc Info : Pyrolysis of thermolag samples Vial Number: 1 -
S arch Libraries: C:\ DATABASE \NBS75K.L Minimum Quality: 0 t
Unkn'own Spectrum: Apex Integration Params: AutoIntegrate
.Pk# RT Area % Library /ID Ref# CAS# Qual ,
1 1.75 22.50 C:\ DATABASE \NBS75K.L j No matches found 2 2.12 3.61 C:\ DATABASE \NBS75K.L No matches found ,
3 2.32 1.93 C:\ DATABASE \NBS75K.L Furan, 2-methyl- 463 000534-22-5 70 Butane, 2,2,3,3-tetranitro- 31332 020919-97-5 32 Furan, 3-methyl- 464 000930-27-8 30 t
4 3.00 4.00 C:\ DATABASE \NBS75K.L 2-Propenoic acid, 2-methyl , 3-hyd 8333 002761-09-3 38 2-Butenoic acid, methyl ester, (E) 63312 000623-43-8 27 2-Butenoic acid, methyl ester, (E) 1458 000623-43-8 27 5 3.50 2.78 C:\ DATABASE \NBS75K.L 1-Penten-3-yne, 2-methyl- 62647 000926-55-6 50 1-Penten-3-yne, 2-methyl- 426 000926-55-6 43 1-Decyne 65925 000764-93-2 38 6 3.86 0.44 C:\ DATABASE \NBS75K.L 2-Octene, (Z)- 2713 007642-04-8 46 Heptanal 64169 000111-71-7 46 2-Octene 63998 000111-67-1 46 7 3.99 0.87 C:\ DATABASE \NBS75K.L 4-Octene, (E)- 64041 014850-23-8 55 2-Octene, (E)- 64023 013389-42-9 50 4-Octene, (E)- 64040'014850-23-8 50 8 4.82 0.14 C:\ DATABASE \NBS75K.L 1H-Pyrrole, 2-methyl- 444 000636-41-9 58 ;
1H-Pyrrole, 1-methyl- 62657 000096-54-8 53 1H-Pyrrole, 3-methyl- 449 000616-43-3 53. i i
9 5.04 4.42 C:\ DATABASE \NBS75K.L Pyridine, 3-methyl- 63044 000108-99-6 95 Pyridine, 3-methyl- 981 000108-99-6 95 Pyridine, 3-methyl- 63046 000108-99-6 91 ;
i C:\HPCHEM\1\ DATA \EM31489B.D Mon Mar 13 17:00:57 1995 Page 1
~
I
.Pk#'**RT-
. Is t '
.Arant Librcry/ID , Ref# CAS# ~ Quni .
^ .;
- 10 - 5.72 2.66 C:\ DATABASE \NBS75K.L.
Phenol 63072 000108-95-2 90 l Phenol 63069 000108-95-2 90 i Phenol. '
1010 000108-95-2 90
~11 5.84 2.16'C:\ DATABASE \NBS75K.L -
i Phenol 63072 000108-95-2 90 Phenol 63069 000108-95-2 90 Phenol 1010 000108-95-2 87 l 12 6.06 3.21 C:\ DATABASE \NBS75K.L Phenol 63070 000108-95-2193 i Phenol 63072 000108-95-2 91 !
Phenol 63071 000108-95-2.87 i 13 6.31 3.02 C:\ DATABASE \NBS75K.L ;
Phenol 63070 000108-95-2L93 :
Phenol 63071 000108-95-2 86 !
Phenol 63072 000108-95-2 76 i l
14- 6.81 1.50 C:\ DATABASE \NBS75K.L .i Pyridine,.3-ethyl- 63740 000536-78-7 64 i Phenol 1010 000108-95-2 60 i Phenol 63070 000108-95-2 55 '
t 15 6.95 0.75 C:\ DATABASE \NBS75K.L i Pyridine, 3-ethenyl- 1970 001121-55-7 50 l 2,4-Heptadien-6-ynal, (E,E)- 2017 007200-04-6 46 !
Phenol 63071 000108-95-2 43 I 16 7.09 4.33 C:\ DATABASE \NBS75K.L !
Pyridine, 3,5-dimethyl- 63720 000591-22-0 95 j Pyridine, 3,5-dimethyl- 2047 000591-22-0 93 Pyridine, 2,5-dimethyl- 2046 000589-93-5 93 17 7.86 0.67 C:\ DATABASE \NBS75K.L ;
1H-Pyrrole-2-acetonitrile, 1-methy 3744 024437-41-0 49 Pyridine, 2-ethyl-6-methyl- 3834 001122-69-6 38 j Benzene, (ethenyloxy) - 64551 000766-94-9 25 ,
18 8.64 3.58 C:\ DATABASE \NBS75K.L ,
Benzyl Alcohol 2119 000100-51-6 90 ;
Phenol, 3-methyl- 63780 000108-39-4 89 l Pyridine, 2,3,5-trimethyl- 3839 000695-98-7 86 i
19 8.93 1.47 C:\ DATABASE \NBS75K.L {
Benzenamine, 3-methyl- 2049 000108-44-1 87 j Aniline, N-methyl- 63713 000100-61-8 86 Phenol, 2-methyl- 2122 000095-48-7 62 ,
1 20 9.11 2.15 C:\ DATABASE \NBS75K.L I Pyridine, 5-ethenyl-2-methyl- 3656 000140-76-1.93 ;
4-Aminostyrene 3652 001520-21-4 76 :
Benzene, 1-methyl (1-methylethyl 65537 000099-87-6 47 i i
C:\HPCHEM\1\ DATA \EM31489B.D Mon Mar 13 17:01:17 1995 Page 2 i
Pk#, RT Arcot Library /ID , Raf# CAS# Qual 21 9.38 4.58 C:\ DATABASE \NBS75K.L Benzenamine, 4-propoxy- 10015 004469-80-1 53 2 (1H) -Pyridinone, 1-methyl- 63813 000694-85-9 53 Pyridine, 3-methyl , 1-oxide 2215 001003-73-2 47
~
22 9.93 1.39 C:\ DATABASE \NBS75K.L
- 1H-Pyrrole, 2,3,4,5-tetramethyl- 4056 001003-90-3 55
[ Pyridinium, 1-(1-carboxyethyl) , h 9987 036880-54-3 35 l Benzenamine, 2-methoxy- 64732 000090-04-0 15 I' 23 10.16 0.39 C:\ DATABASE \NBS75K.L Cyclopropanamine, 2-phenyl , trans 65459 000155-09-9 25 Thiourea, tetramethyl- 5727 002782-91-4 16 Quinoline, 1,2,3,4-tetrahydro- 65454 000635-46-1 16 24 10.67 0.40 C:\ DATABASE \NBS75K.L 1H-Benzimidazol-2-amine 65439 000934-32-7 25 Benzene, 1-isocyanato-4-methyl- 65450 000622-58-2 18
[1,2,4] Triazolo [1,5 -al pyridine , 2- 5960 000768-19-4 18 25 10.84 0.55 C:\ DATABASE \NBS75K.L 1,2,4 -Triazolo [4,3-a] pyridine, 3-m 5957 001004-65-5 25 Benzene, 1-isocyanato-3-methyl- 5981 000621-29-4 20 Cyclopropanamine, 2-phenyl , trans 65460 000155-09-9 18 26 11.46 1.99 C:\ DATABASE \NBS75K.L Ethanol, 2-phenoxy- 6911 000122-99-6 96 Ethanol, 2-phenoxy- 65894 000122-99-6 93 Ethanol, 2-phenoxy- 65895 000122-99-6 76 27 11.98 0.33 C:\ DATABASE \NBS75K.L 1,3,5-Triazine, hexahydro-1,3,5-tr 65158 000108-74-7 30 ;
3-Buten-2-one, 4- (dimethylamino) -4 8161 049582-68-5 27 l 2-Propenoic acid, 3- (dimethylamino 12144 049582-69-6 22 l 28 12.59 0.23 C:\ DATABASE \NBS75K.L Pentanedioic acid, diethyl ester 19778 000818-38-2 49 Pentanedioic acid, diethyl ester 69155 000818-38-2 46 Pentanedioic acid, diethyl ester 69156 000818-38-2 43 29 12.81 0.31 C:\ DATABASE \NBS75K.L dl-3-Aminobutyric acid 1815 002835-82-7 43 2-Butenediamide, (Z) - 2831 000928-01-8 38 3,4-Dithiahexyl-1,6-diamine 10077 000000-00-0 38 30 13.07 0.51 C:\ DATABASE \NBS75K.L Propanal, dimethylhydrazone 1498 007422-93-7 35 1,3-Propanediol, 2,2-bis (hydroxyme 6397 000115-77-5 35 Hexanal, 5- thyl- 2998 001860-39-5 35, 31 13.25 0.47 C:\ DATABASE \NBS75K.L 3,4-Dithiahexyl-1,6-diamine 10077 000000-00-0 35 Acetoacetic acid, 3-thio , propyl 12292 018457-87-9 30 {
Benzenemethanol, 4-hydroxy . alpha. 68042 000094-07-5 16 C:\HPCHEM\1\ DATA \CM31489B.D Mon Mar 13 17:01:49 1995 Page 3
,Pk#, RT Arcc% Librcry/ID , Raf# CAS# Qual
-32 13.48 0.55 C:\ DATABASE \NBS75K.L Piperidine, 4-methyl- 63291 000626-58-4 43 3 -Azabicyclo [3. 2. 2] nonane , 3-nitro 67057 001522-09-4 18 1,3,5-Triatin-2 (1H) -one , 4-amino-6 11106 007313-54-4 14 33 16.23 0.34 C:\ DATABASE \NBS75K.L -
Ethanol, 2- (2-phenoxyethoxy)- 18349 000104-68-7 53 i l Propanoic acid, 3-methoxy , methyl 64414 003852-09-3 18 I
3-Propoxyamphetamine 21000 000000-00-0 14 I 34 17.04 0.27 C:\ DATABASE \NBS75K.L Benzene, 1-nitro (1-propynyl) - 12652 028289-83-0 53 )
6-Amino-2,3-dimethyl (1H)pyrrolo[2, 12683 000000-00-0 45 l Urea, N-methyl-N ' - [4 - (trifluoroace 32948 057346-65-3 42 1 35 17,72 0.47 C:\ DATABASE \NBS75K.L Phenol, 4,4 '- (1,2-diethyl-1,2-etha 37831 000084-16-2 59 Phenol, 4-(1,1,3,3-tetramethylbuty 24424 000140-66-9 58 Phenol, 4-(1,1,3,3-tetramethylbuty 70047 000140-66-9 50 36 18.32 1.24 C:\ DATABASE \NBS75K.L 2 - Propanol , 1, l ' - [ (1 -me thyl-1, 2 - e t 20630 001638-16-0 38 2,5,8,11,14-Pentaoxapentadecane 28004 000143-24-8 38 2-Butanol, 3-methoxy- 1908 053778-72-6 38 )
l 37 18.46 0.71 C:\ DATABASE \NBS75K.L 2 - Propanol , 1 - [1 -methyl ( 2 - prope 16196 055956-25-7 38 {
2-Propanol, 1, l ' - [ (1-methyl- 1, 2 -e t 20630 001638-16-0 38 i Pentane, 2-methoxy- 1778 006795-88-6 35 38 19.09 0.50 C:\ DATABASE \NBS75K.L 2 -Propanol, 1- [1-methyl ( 2 -prope 68438 055956-25-7 42 1-Propanol, 2-(2-hydroxypropoxy)- 6086 000106-62-7 38 2 - Propanol , 1, l ' - [ (1-me thyl- 1, 2 - et 69286 001638-16-0 35 39 19.37 0.22 C:\ DATABASE \NBS75K.L Butanamide 62880 000541-35-5 43 Butanamide 755 000541-35-5 43 Propanediamide 1670 000108-13-4 43 40 19.53 0.12 C:\ DATABASE \NBS75K.L N-Methyl-2-benzyloxyethylamine 13744 071126-62-0 47 3-Isoxazolecarboperoxoic acid, 5-p 36039 035145-87-0 47 Butanamide 62880 000541-35-5 47 41 19.93 1.01 C:\ DATABASE \NBS75K.L 3-Cyclobutene-1,2-dicarboxylic aci 29065 055673-92-2 25 1H-Purine, 6- (methylthio) - 13832 000050-66-8 22 Benzo [b] thiophene, 3-(butylthio)- 28072 054965-44-5 20 p 42 20.17 0.47 C:\ DATABASE \NBS75K.L cis-2,4,5-Trimethoxy . beta.-methyl 34481 000000-00-0 43 1,5-Diphenyl-2H-1,2,4-triazoline-3 34508 005055-74-3 38 7- (2-Hydroxyphenyl) (7H) triazolo [e] 34463 000000-00-0 38 I
CHEM \1\ DATA \EM31489B.D Mon Mar 13 17:02:17 1995 Page 4
Pk# RT Arcat Library /ID ,
R2f# CAS# Qual
,* e 43 20.26 1.22 C:\ DATABASE \NBS75K.L Flavona 28172 000525-82-6 35 7, 8 -Dihydro-2 -me thyl (6H) pyrazolo [3 27965 000000-00-0 25 1H-Pyrrole-2-carboxylic acid, 3-et 14264 069687-81-6 11
~
44 20.57 0.10 C:\ DATABASE \NBS75K.L -
1H-Indole-3-ethanamine, 6-fluoro . 20703 077590-52-4 38 Tricyclo [4 . 3.1.13. 8] undecane-3 -car 21336 021898-91-9 32 N-Methyl-2-benzyloxyethylamine 13744 071126-62-0 30 45 20.89 1.37 C:\ DATABASE \NBS75K.L i
3-(3-Methoxyphenyl) propionic acid 24861 007116-39-4 38 Pyridine, 2-ethyl-4,6-dimethyl- 6309 001124-35-2 14 Phenol, 2- [ (1-piperidyl) pyri 34940 000000-00-0 11 46 21.16 0.87 C:\ DATABASE \NBS75K.L 1H-Purin-6-amine, N-methyl- 66644 000443-72-1 30 7H-Purin-6-amine, 7-methyl- 9421 000935-69-3 20 4-Pyridinecarboxaldehyde, 3-hydrox 14236 000066-72-8 18 47 21.49 0.24 C:\ DATABASE \NBS75K.L 12,13-Dihydro-12-methyl-13,14-diox 46505 059050-19-0 10 1,3 -Dioxane , 4 - (hexadecyloxy) pe 59841 056599-40-7 10 Benzoic acid, 2-[(2-aminophenyl) [3 46493 013450-59-4 10 48 21.78 0.35 C:\ DATABASE \NBS75K.L 5,9-Methanobenzocycloocten-4 (1H) -o 38853 006244-16-2 53 Pyrido [3,2-d] pyrimidine-2,4 (1H,3H) 24033 016953-81-4 50 4H-1-Benzopyran-4-one, 5,7-dihydro 36247 013475-09-7 40 49 21.90 0.57 C:\ DATABASE \NBS75K.L Propanoic acid, 2-hydroxy-2-methyl 3494 002110-78-3 49 Propane, 1-ethoxy-2-methyl- 63543 000627-02-1 47 2 - Propanol , 1 - [1-me thyl ( 2 -prope 68433 055956-25-7 47 50 22.09 6.30 C:\ DATABASE \NBS75K.L Methane, diethoxy- 63623 000462-95-3 47 2,5,8,11,14-Pentaoxapentadecane 70591 000143-24-8 47 2 - Propanol , 1, l ' - [ (1-methyl -1, 2 -e t 69286 001638-16-0 47 51 22.43 0.46 C:\ DATABASE \NBS75K.L 1,2-Benzisothiazole-3-acetic acid 69333 029266-68-0 50 Benzene, 1-isocyanato-2-methoxy- 9446 000700-87-8 43 Tri cyclo [4 . 3 .1.13 , 8 ) unde cane ca r 24915 031083-60-0 38 52 22.79 0.65 C:\ DATABASE \NBS75K.L Hexylene Glycol 3548 000107-41-5 38 Propanoic acid, 2-hydroxy-2-methyl 5790 000080-55-7 35 2-Pentanol, 3-chloro-2-methyl- 6423 074685-49-7 35 53 23.12 0.11 C:\ DATABASE \NBS75K.L ;
L-Threonine, N- [ (1H-purin-6-ylamin 39347 033422-66-1 37 l Allyldimethylphenylsilane 16746 000000-00-0 16 ;
3,3-Dimethyl-1-phenylazetidine-4-t 20482 096594-26-2 11 l C:\HPCHEM\1\ DATA \EM31489B.D Mon Mar 13 17:02:41 1995 Page 5 l
l
~
Pk# RT Arco % Librcry/ID ,
Raf# CAS# Qual 54 25.27 0.58 C:\ DATABASE \NBS75K.L Acetamide 103 000060-35-5 49 Butanamide
- 62880 000541-35-5 49 1,2-Dideoxy-1-erythro-pentitol 3714 000000-00-0 47 55 27.51 0.05 C:\ DATABASE \NBS75K.L
- Phosphoric acid, triphenyl ester 73338 000115-86-6 96 Phosphoric acid, triphenyl ester 73337 000115-86-6 91 Phosphoric acid, triphenyl ester 46311 000115-85-6 43 56 27.87 3.22 C:\ DATABASE \NBS75K.L Octicizer 50542 001241-94-7 90 7-Amino-2,3-dihydro-5-phenyl-1H-1, 34112 004928-02-3 59 2-(4-Cyanophenyl)-5-dimethylaminom 34091 000000-00-0 45 57 28.10 0.29 C:\ DATABASE \NBS75K.L 5-Methoxy-2,3-dimethylindole 68483 000828-94-4 42 58 31.62 0.17 C:\D7.TABASE\NBS75K.L Phosphoric acid, tris (3 -methylphen 51124 000563-04-2 99 Phosphoric acid, tris (methylphenyl 51123 001330-78-5 98 Phosphoric acid, tris (methylphenyl 73955 001330-78-5 90 59 32.26 0.21 C:\ DATABASE \NBS75K.L Phosphoric acid, tris (3-methylphen 51124 000563-04-2 98 Phosphoric acid, tris (methylphenyl 73955 001330-78-5 97 Phosphoric acid, tris (4 -methylphen 51126 000078-32-0 94 1
l C:\HPCHEM\1\ DATA \EM31489B.D Mon Mar 13 17:02:54 1995 Page 6
Area Percent Report -- Sorted by Signal 9
Information from Data File:
- File : C:\HPCHEM\1\ DATA \EM31489B.D operator : Marti Acquired : 13 Mar 95 4:24 pm using AcqMethod EM31492 S mple Name: 0395-10b Misc Info : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M Retention Time Area Area % Ratio %
Total Ion Chromatogram 1.750 954305392 22.503 100.000 2.116 152921970 3,606 16.024 2.318 81908496 1.931 8.583 2.998 169600055 3.999 17.772 3.505 117713779 2.776 12.335 3.860 18497745 0.436 1.938 3.991 36891432 0.870 3.866 4.817 6060750 0.143 0.635 5.043 187328572 4.417 19.630 5.717 112918982 2.663 11.833 l 5.845 91762311 2.164 9.616 6.053 136107108 3.209 14.262 6.308 128036601 3.019 13.417 6.813 63700901 1.502 6.675 6.946 31599212 0.745 3.311 7.098 183748915 4.333 19.255 7.856 28389921 0.669 2.975 8.639 151765542 3.579 15.903 8.927 62526516 1.474 6.552 9.110 91308371 2.153 9.568 9.388 194169699 4.579 20.347 9.930 58982071 1.391 6.181 10.160 16688500 0.394 1.749 10.676 17065284 0.402 1.788 10.838 23221927 0.548 2.433-11.459 84397421 1.990 8.844 11.987 13845898 0.326 1.451 12.591 -9649769 0.228 1.011 12.807 13297643 0.314 1.393 13.067 21600833 0.509 2.264 13.248 20008162 0.472 2.097
~
13.472 23194810 0.547 2.431 16.225 14449911 0.341 1.514 17.043 11407430 0.269 1.195 17.718 19902446 0.469 2.086 i
C:\HPCHEM\1\ DATA \EM31489B.D Wed Mar 22 13:39:27 1995 Page 1
?? .
c u, ,
f.-
Area-Percent Report -- Sorted by-Signal.
i --
Information from Data File: '
- File :-.C:\HPCHEM\1\ DATA \EM31489B.D Operator. : Marti
.AcquiredL :'13-Mar 95 4:24 pm using AcqMethod EM31492 Sample Name: 0395-10b- .
Misc Info : ' Pyrolysis;of thermolag samples L Vial' Number: 1 H 'CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M
, Retention Time Area' Area % Ratio %
18.321 52502105 -1.238 5.502 18.465 29901719: 0.705 3.133 19.093 21057747 0.497 2.207 19.368 9353431- 0.221 0.980 19.531 5144746 0.121 0.539 19.927 42840257 1.020 4.489 20.162 19996113 0.472 2.095 20.261 51906184 1.224 5.439 20.569 .4073155 0.096 0.427 20.891 57926561 1.366 6.070 21.160 37068995 0.874 3.884 21.494- 10352899 0.244 1.085 21.772 15023198 0.354 1.574 21.898 24136240 0.569 2.529 22.089 267247697 6.302 28.004 22.432 19367144 0.457 2.029 22.793 27473109 0.648 2.879 23.129 4801595 0.113 0.503 25.269 24639302 0.581 2.582 27.512 2178380 0.051 0.228 27.869 136746015 3.225 14.329 28.098 12090531 0.285 1.267 31.619 7167849 0.169 0.751 32.261 8806779 0.208 0.923 C:\HPCHEM\1\DAT.A\EM31489B.D Wed Mar 22 13:39:29 1995 Page 2
g._
I Area Percent Report -- Sorted'by Signal
~
- -Information from Data File
- .
-File : C:\HPCHEM\1\ DATA \EM31489B.D.
. Operator : Marti i Acquired : 13 Mar 95 _4:24 pm using AcqMethod EM31492
-Simple Name: 0395-10b
. Misc' Info' : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M Retention Time Area Area % Ratio %
55.00 amu 2.873 18949653 66.313 100.000 3.447 1358246 4.753 7.168
-3.875 2344804 8.206 12.374 3.988 2868408 10.038 15.137 4.135 1411830 4.941 7.450 5.731 1339782 4.689 7.070 .
5.837 303162 1.061 1.600 69.00 amu
- 2.362 592491 4.103 4.279 '
3.001 16183842 95.897 100.000 l
t- !
l i
C:\HPCHEM\1\ DATA \EM31489B.D Wed Mar 22 13:39:52 1995 . Page 1
File- : C:\HPCHEM\1\ DATA \EM31489C.D-Operator- : Marti Acquired : 13 Mar 95 5:43 pm using AcqMethod EM31492
< Instrument : 5972 - 33 Sample Name: 0395-10c .
-Misc Info : Pyrolysis of thermolag samples Vial Number: 1 FIGURE 5 Acundance TIC: EM31489c.D
[-
7000000 65000002 6000000-5500000_'
5000000-4500000-4000000_
3500000_
3000000-l $
2500000.
I 2000000 j '
L i k !
i1500000. .!j! j
! : n" , .
h; U i 1
l1000000.] '
j '
j ' '-
I lg I5 j js y> v,.itJjh/dy.!Qg[g(.d m)
Time--> 5.'00 10.00 15 00 20.00 25.00 30.00
File : C:\HPCHEM\1\ DATA \EM31489C.D.
Operator : Marti Acquired : 13 Mar 95 5:43 pm using AcqMethod EM31492 Instrument : 5972 - 33 -
Sample Name: 0395-10c -
Misc Info : Pyrolysis of thermolag samples
. Vial Number: 1 L MGURE6 l Kbundance Ion 55.00 (54.70 to 55.70TTTM314ssc.D l J 2.1,86 l1400000 l
- 1 i 1 -
1200000.2 l
i 1000000 l 7
1 800000- l 4
l
.600000; l
400000j 200000 ,
l 1.%$52.31
- O b WW E- -
Time--> 1.'00 2.'00 3.'00 4.'00 5.00 Anunchlice lon 69.00 (65.70 to 69.70): EM31459C.D i
14000002 i
1200000.*
2.99 1000000.i i
800000; 600000; 400000; li li 2000002 i 3.82 [
0" - - - \ I
. Time--> 1.'00 2.00 3.00 4.00 5.00 l
Information from D2tc Filo: .
'Filo : C:\HPCHEM\1\ DATA \EM31489C.D Operator : Marti Acquired : 13 Mar 95 5:43 pm using AcqMethod EM31492 S:mple Name: 0395-10c Misc Info : Pyrolysis of thermolag samples Vial Number: 1 ,'
Scarch Libraries: C:\ DATABASE \NBS75K.L Minimum Quality: 0 Unknown Spectrum: Apex Integration Params: AutoIntegrate Pk# RT Areat Library /ID Ref# CAS# Qual 1 1.72 18.72 C:\ DATABASE \NBS75K.L No matches found 2 2.11 6.84 C:\ DATABASE \NBS75K.L 2-Propenal, 2-methyl- 209 000078-85-3 91 2-Propenal, 2-methyl- 62430 000078-85-3 91 2-Butenal, (E)- 214 000123-73-9 91 !
3 2.30 3.61 C:\ DATABASE \NBS75K.L Furan, 2-methyl- 463 000534-22-5 94 Furan, 2-methyl- 62666 000534-22-5 86 Furan, 2-methyl- 62665 000534-22-5 64 4 2.71 2.56 C:\ DATABASE \NBS75K.L Furan, 2-methyl- 62665 000534-22-5 91 Furan, 2-methyl- 463 000534-22-5 91 Furan, 2-methyl- 62666 000534-22-5 90 5 2.86 2.80 C:\ DATABASE \NBS75K.L 2-Propenoic acid, ethyl ester 63318 000140-88-5 91 2-Propenoic acid, ethyl ester 1461 000140-88-5 91 2-Propenoic acid, ethyl ester 63319 000140-88-5 83 6 2.99 7.22 C:\ DATABASE \NBS75K.L 2-Propenoic acid, 2-methyl , methy 63329 000080-62-6 64 2-Butenoic acid, methyl ester, (E) 1458 000623-43-8 59 2-Propenoic acid, 2-methyl , methy 1484 000080-62-6 58 ;
7 3.33 1.59 C:\ DATABASE \NBS75K.L 2-Butenal, 2-methyl- 574 001115-11-3 93 2-Butenal, 2-methyl , (E)- 565 000497-03-0 93 2-Ethylacrolein 551 000922-63-4 64 8 3.61 0.77 C:\ DATABASE \NBS75K.L i Toluene 63028 000108-88-3 92-Toluene 63029 000108-88-3 70 ,
Toluene 63030 000108-88-3 70 '
9 3.84 0.29 C:\ DATABASE \NBS75K.L 2-Pentenal, (E)- 62733 001576-87-0 25 2-Pentenal, (E)- 567 001576-87-0 25 2-Pentene, 4-methyl , (Z)- 601 000691-38-3 18 C:\HPCHEM\1\ DATA \EM31489C.D Mon Mar 13 18:20:00 1995 Page 1 l
7 Pk# ,.RT ' Arco % Librcry/ID . Rsf# CAS# Quni 10 4.23 0.22 C:\ DATABASE \NBS75K.L ,
1-Methoxy-1,3-cyclohexadiene 2313 002161-90-2 49 !
2,3,5-Trimethylfuran -
2288 000000-00-0 46 ,
1H-Imidazole, 2-ethyl-4-methyl- . 2275 000931-36-2 41 11 4.78- 0.37 C:\ DATABASE \NBS75K.L )
1-Penten-3-yne, 2-methyl- 62647 000926-55-6 55 Ricyclo (3. 3.1) non-2 -ene 3973 006671-66-5 47 -
1-Penten-3-yne, 2-methyl- 426 000926-55-6 46 !
12 5.12 3.59 C:\ DATABASE \NBS75K.L Benzene, 1,2-dimethyl- 63706 000095-47-6 91 '
Benzene, 1,3-dimethyl- 63697 000108-38-3 91- -
p-Xylene 63701 000106-42-3 91 13 5.52 0.19 C:\ DATABASE \NBS75K.L '
Benzene, 1,2-dimethyl- 63706 000095-47-6 25 :
Benzene, (ethenyloxy) - 3759 000766-94-9 22 Bicyclo [3. 2.1] octane , 2,3-bis (meth 6229 049826-54-2 17 14 6.31 0.37 C:\ DATABASE \NBS75K.L ;
Pyridine, 2,5-dimethyl- 63719 000589-93-5 93 Pyridine, 2,3-dimethyl- 63734 000583-61-9 92 -
Pyridine, 2,3-dimethyl- 2053 000583-61-9 92 15 6.80 1.00 C:\ DATABASE \NBS75K.L ,
Benzene, 1-ethyl-2-methyl- 3765 000611-14-3 70 Benzene, 1,2,3-trimethyl- 64576 000526-73-8 64 Benzene, 1-ethyl-3-methyl- 64563 000620-14-4 64 16 6.94 0.39 C:\ DATABASE \NBS75K.L l Pyridine, 3-ethenyl- 1970 001121-55-7 74 2,4-Heptadien-6-ynal, (E,E)- 2017 007200-04-6 70 i Benzene, 1-azido-2-methyl- 65441 031656-92-5 53 !
17 7.11 1.59 C:\ DATABASE \NBS75K.L Pyridine, 3,5-dimethyl- 63720 000591-22-0 93 Pyridine, 3,5-dimethyl- 2047 000591-22-0 93 '
Pyridine, 2,5-dimethyl- 2046 000589-93-5 93 18 7.37 1.14 C:\ DATABASE \NBS75K.L 1,2,4-Trimethylbenzene 3771 000095-36-3 94 l Benzene, 1,2,3-trimethyl- 64576 000526-73-8 93 Benzene, 1,3,5-trimethyl- 64568 000108-67-8 76 ,
19 7.85 1,59 C:\ DATABASE \NBS75K.L '
Phenol, 3-methyl- 63780 000108-39-4 56 '
Pyridine, 2,3-dimethyl- 2053 000583-61-9 45 Phenol, 2-methyl- 63789 000095-48-7 42-20 8.62 1.63 C:\ DATABASE \NBS75K.L Pyridine, 2,3,6-trimethyl- 3822 001462-84-6 81 !
Benzenamine, 3,4-dimethyl- 3838 000095-64-7 76 )
Benzenamine, 2,4-dimethyl- 3840 000095-68-1 76 '
i C:\HPCHEM\1\ DATA \EM31489C.D Mon Mar 13 18:20:22 1995 Page 2 i l
,Pk# RT. Arcc% Librcry/ID . R3f# CAS# Qu21 l
21 8.92 0.67 C:\ DATABASE \NBS75K.L !
Benzenamine, 2,4-dimethyl- 64620 000095-68-1 86 Benzenamine, 2,6-dimethyl- 64610 000087-62-7 76 ;
Benzenamine, 2,5-dimethyl- 3818 000095-78-3 76 22 9.10 1.50 C:\ DATABASE \NBS75K.L Pyridine, 5-ethenyl-2-methyl- 3656 000140-76-1 91 Benzene, 1-methyl (1-methylethyl 6201 000099-87-6 59 Benzene, s-ethyl-1,2-dimethyl- 65569 000934-80-5 59 23 9.34 1.99 C:\ DATABASE \NBS75K.L 2,6-Pyridinediamine 2190 000141-86-6 50
, Pyridine, 3-methyl , 1-oxide 2215 001003-73-2 47 l Phenol, 3-amino- 2210 000591-27-5 47 24 9.77 0.21 C:\ DATABASE \NBS75K.L Benzene, 1-ethyl-2,3-dimethyl- 65355 000933-98-2 42 Benzene, 1,2,3,4-tetramethyl- 6202 000488-23-3 42 Benzene, 1-methyl-2-(1-methylethyl 65581 000527-84-4 42 25 9.91 1.05 C:\ DATABASE \NBS75K.L 1H-Pyrrole, 2,3,4,5-tetramethyl- 4056 001003-90-3 90 Borane, ethylbis (2, 3,4,5-tetrameth 40184 028916-15-6 72 l 5-Dimethylaminopyrimidine 4021 031401-46-4 35 26 10.15 0.39 C:\ DATABASE \NBS75K.L Benzene, (2-methyl-2-propenyl)- 5895 003290-53-7 53 Benzene, 1-ethenyl-3-ethyl- 5902 007525-62-4 50 o-Isopropenyltoluene 5877 007399-49-7 49 27 10.35 0.86 C:\ DATABASE \NBS75K.L l
Benzenamine, 2-(1-methylethyl)- 6343 000643-28-7 64 Pyridine, 3-ethyl-2,6-dimethyl- 6322 023580-52-1 46 Benzenamine, 2-ethyl-6-methyl- 6340 024549-06-2 43 l 28 10.66 0.46 C:\ DATABASE \NBS75K.L Benzenamine, 2-(1-methylethenyl)- 5989 052562-19-3 58 Benzene, 1-isocyanato-3-methyl- 5981 000621-29-4 46 Furo [2,3 -c] pyridine , 2-methyl- 5968 069022-76-0 46 29 10.82 0.48 C:\ DATABASE \NBS75K.L Benzene, 1-isocyanato-3-methyl- 5981 000621-29-4 38 Benzene, 1-isocyanato-3-methyl- 65449 000621-29-4 30 Diethyl N-hydroxycarbonimidate 5936 024770-46-5 27 30 10.95 0.41 C:\ DATABASE \NBS75K.L l
1H-Indene, 2,3-dihydro-1,3-dimethy 8968 004175-53-5 87 1H-Indene, 2,3-dihydro-1,6-dimethy 8967 017059-48-2 55 1H-Indene, 2,3-dihydro-4,7-dimethy 66497 006682-71-9 46-31 11.27 6.54 C:\ DATABASE \NBS75K.L Ethanol, 2-phenoxy- 6911 000122-99-6 96 Ethanol, 2-phenoxy- 65894 000122-99-6 94 Ethanol, 2-phenoxy- 65895 000122-99-6 91 C:\HPCHEM\1\ DATA \EM31489C.D Mon Mar 13 18:20:44 1995 Page 3
..Pk#., RT AraO% Librcry/ID . Raf# CAS# QuS1 32 11.98 0.63 C:\ DATABASE \NBS75K.L Dimethyl ethylbutane-1,4-dioate 16107 000000-00-0 22 1,2,4-Thiadiazole, 5-amino-3-propy 8127 032039-20-6 15 2 -Naphthalenol, 1- (1H-naphth (1, 2 - e, 48287 050617-01-1 14 33 12.24 1.30 C:\ DATABASE \NBS75K.L Ethanol, 2- (2-phenoxyethoxy) - 18349 000104-68-7 55 1,4,7,10,13,16-Hexaoxacyclooctadec 71827 017455-13-9 12 2-Butanone, 3-hydroxy- 799 000513-86-0 10 34 12.58 1.18 C:\ DATABASE \NBS75K.L Pentanedioic acid, diethyl ester 19778 000818-38-2 87 Pentanedioic acid, diethyl ester 69156 000818-38-2 64 Carboxin 71050 005234-68-4 43 35 13.06 0.46 C:\ DATABASE \NBS75K.L Pyrazine, 2,5-dimethyl-3-propyl- 9760 018433-97-1 15 2-Amino-1-(0-methoxyphenyl) propane 13749 074702-94-6 11 Phenol, 2,5-dimethyl- 64689 000095-87-4 11 36 13.47 1.70 C:\ DATABASE \NBS75K.L Diethyl isopropylidenemalonate 69708 006802-75-1 35 2 - (Die thylamino) methylcycloprop 11187 091295-98-6 35 Fumaric Acid 64253 000110-17-8 25 37 13.67 0.82 C:\ DATABASE \NBS75K.L 1H-Indole-3-carboxylic acid 12666 000771-50-6 41 Pyrido [3,4 -d] pyrimidin-4 (3H) -one , 12637 022389-82-8 38 Pyrido [3,2-d] pyrimidin-4 (3H) -one, 12641 003303-26-2 38 38 14.29 0.37 C:\ DATABASE \NBS75K.L Benzene, 1,3,5-trimethyl-2-(1,2-pr 12108 029555-07-5 90 Benzene, 1,4 -bis (1-methylethenyl) - 12102 001605-18-1 64 Quinoline, 4-methyl- 8213 000491-35-0 30 39 14.83 0.42 C:\ DATABASE \NBS75K.L 1H-Indole, 5-fluoro- 6266 000399-52-0 38 Phenol, 2-methyl-5-(1-methylethyl) 66780 000499-75-2 35 Benzeneacetonitrile, 4-fluoro- 6267 000459-22-3 35 40 15.33 0.75 C:\ DATABASE \NBS75K.L 1-Chloro-2-ethoxyethane 2079 000628-34-2 52 1-Propanol, 2- (2-methoxypropoxy) - 9232 013588-28-8 35 2-Propanol, 1-methoxy-2-methyl- 1912 003587-64-2 30 41 15.59 0.38 C:\ DATABASE \NBS75K.L Pyrido [2,3 -d] pyrimidine, 4-ethyl- 12167 028732-68-5 27 Propanedioic acid, diazo , dimethy 11789 006773-29-1 25 1,8-Naphthyridine, 2,6-dimethyl- 12031 014757-45-0 25-42 15.86 1.18 C:\ DATABASE \NBS75K.L 2-Naphthalenemethanol, decahydro . 28201 000473-15-4 45 Butanoic acid, 2-hydroxy , methyl 3508 029674-47-3 38 1-Propanol, 2- (2^-methoxypropoxy) - 9232 013588-28-8 38 C:\HPCHEM\1\ DATA \EM31489C.D Mon Mar 13 18:21:17 1995 Page 4
..Pk#,.RT Areat Library /ID . Ref# CAS# Qual 43 16.09 0.76 C:\ DATABASE \NBS75K.L 2,5,8,11,14-Pentaoxapentadecane 70592 000143-24-8 38 2-Butanol, 3-methoxy- -
1908 053778-72-6 38 2,5,8,11,14,17-Hexaoxaoctadecane ,
36869 001191-87-3 35
~
44 16.36 0.68 C:\ DATABASE \NBS75K.L '
Ethanol, 2-(2-phenoxyethoxy)- 18349 000104-68-7 96 2-Benzyloxyethylamine 10017 038336-04-8 35 Ethanol, 2-phenoxy- 6911 000122-99-6 32 45 17.04 0.28 C:\ DATABASE \NBS75K.L 2,5,8,11,14,17-Hexaoxaoctadecane 36869 001191-87-3 38 2 - Propanol , 1, l ' - [ (1 -me thyl- 1, 2 - e t 20630 001638-16-0 35 2 - Propanol , 1 - [1-me thyl ( 2 -prope 68438 055956-25-7 27 46 17,75 0.27 C:\ DATABASE \NBS75K.L Phenol, 4- (1,1,3,3-tetramethylbuty 24424 000140-66-9 49 Thymol 66820 000089-83-8 47 Tricyclo [4 . 3.1.13, 8] undecane , 3-ch 18853 027011-47-8 47 47 18.02 0.12 C:\ DATABASE \NBS75K.L Phenol, 3-pentyl- 13529 020056-66-0 30 Phenol, 3-octyl- 70046 020056-69-3 27 Phenol, 3-octyl- 24422 020056-69-3 27 48 18.36 1.97 C:\ DATABASE \NBS75K.L Methane, diethoxy- 63623 000462-95-3 38 2-Propanol, 1, l ' - [ (1-me thyl-1, 2 -et 69286 001638-16-0 38 2-Butanol, 3-methoxy- 1908 053778-72-6 38 49 18.50 1.35 C:\ DATABASE \NBS75K.L Methane, diethoxy- 63623 000462-95-3 38 Ethanol, 1-methoxy , benzoate 17716 051835-44-0 27 Butanoic acid, 2-hydroxy , methyl 3508 029674-47-3 27 50 18.76 0.52 C:\ DATABASE \NBS75K.L -
2,3-Dihydroindole-2-one, 3-fluoro- 28009 000000-00-0 27 Phenol, 2-(2-quinoxalinyl)- 28139 017392-20-0 15 Flavone 28172 000525-82-6 15 51 19.11 0.60 C:\ DATABASE \NBS75K.L 2 -Propanol , 1- [1 -me thyl (2 -prope 68438 055956-25-7 50 2-Propanol, 1,l'-oxybis- 6087 000110-98-5 43 1-Propanol, 2- (2-hydroxypropoxy) - 6086 000106-62-7 43 52 19.61 0.72 C:\ DATABASE \NBS75K.L Phenol, 2-[4-(1-piperidinyl)-2-pyr 34941 075634-06-9 15 2-Ethyl-3,5-dimethylpyridine 6325 001123-96-2 14 Pyridine, 2,6-diethyl- 65618 000935-28-4 14-53 19.95 0.71 C:\ DATABASE \NBS75K.L 1-Hydroxy-4-hydrazonomethyl-2,0,5, 22779 051973-32-1 20 6H- Purin- 6 -one , 2- (dimethylamino) - 68656 001445-15-4 18 Carbamic acid, (2,6-dimethylphenyl 17450 020642-93-7 18 C:\HPCHEM\1\ DATA \EM31489C.D Mon Mar 13 18:21:44 1995 Page 5
.,Pk#. RT Aract Library /ID -
Raf# CAS# Qual 54 20.26 0.71 C:\ DATABASE \NBS75K.L 4,7-Methanobenzoxazole, octahydro- 21596 032235-39-5 51 i Phenol, 2- (2-quinoxalinyl) - 28139 017392-20-0 35 1,l'-Biphenyl, 3-azido- ,
21582 014213-01-5 25 55 20.41 0.18 C:\ DATABASE \NBS75K.L 2 - (4 - (Dime thylamino) naphthyl) na 46514 000000-00-0 25 1,3-Dioxane, 5- (hexadecyloxy) pe 74670 034315-34-9 25 l ' H- Andros t eno [17,16 -g] indol- 3 54335 056196-20-4 25 56 20.73 0.19 C:\ DATABASE \NBS75K.L Pyrido [3,2-d] pyrimidine-2,4 (1H,3H) 24033 016953-81-4 47 5 - (4 -Nexyloxybenzoyloxy) (4 -nitr 55386 000000-00-O'47 5,9-Methanobenzocycloocten-4 (1H) -o 38853 006244-16-2 43 57 20.90 0.81 C:\ DATABASE \NBS75K.L 4-Amino-5-(2-hydroxypfenylazo) benz 34893 000000-00-0 11 Benzenamine, N,N,4-trimethyl- 6330 000099-97-8 11 Phenol, 2- [4 - (1-piperidinyl) pyr 34941 075634-06-9 11 58 21.16 3.35 C:\ DATABASE \NBS75K.L 2,5,8,11,14-Pentaoxapentadecane 70592 000143-24-8 43 2 - Propanol , 1 - [1 -me thyl ( 2 -prope 68438 055956-25-7 38 Propanoic acid, 2-hydroxy-2-methyl 3494 002110-78-3 38 59 21.91 0.41 C:\ DATABASE \NBS75K.L 2-Naphthalenemethanol, decahydro . 28201 000473-15-4 53 2,4, 6, 8, 9 -Pentathia tricyclo [3 . 3 .1. 42667 057274-31-4 47 Propanoic acid, 2-hydroxy-2-methyl 3494 002110-78-3 46 60 22.08 2.79 C:\ DATABASE \NBS75K.L 2 - Propanol , 1- [1 -me thyl ( 2 -prope 68438 055956-25-7 50 1-Chloro-2-ethoxyethane 2079 000628-34-2 47 2-Butanol, 3-methoxy- 1908 053778-72-6 43 61 22.44 0.21 C:\ DATABASE \NBS75K.L 2H-1,4 -Benzoxazin-3 (4H) -one 9435 005466-88-6 35 Tricyclo [4 . 3 .1.13 , 8 ] unde cane car 21333 031061-65-1 35 1,3-Dioxolane, 2-methyl-2-phenyl- 67836 003674-77-9 27 62 27.64 1.42 C:\ DATABASE \NBS75K.L 7-Amino-2,3-dihydro-5-phenyl-1H-1, 34112 004928-02-3 53 Octicizer 50542 001241-94-7 47 2 - ( 4 - Cyanophenyl) dime thylaminom 34091 000000-00-0 42 63 27.86 1.59 C:\ DATABASE \NBS75K.L 7-Amino-2,3-dihydro-5-phenyl-1H-1, 34112 004928-02-3 59 Octicizer 50542 001241-94-7 45 2 - ( 4 - Cyanophenyl ) dime t hyl aminom 34091 000000-00-0 45-64 28.10 0.15 C:\ DATABASE \NBS75K.L 2,3,4,5-Tetrafluorobenzonitrile 16392 016582-93-7 43 Oxypertine 52141 000153-87-7 23 1-Naphthalenol, 5,6,7,8-tetrahydro 27257 055012-72-1 23 C:\HPCHEM\1\ DATA \EM31489C.D Mon Mar 13 18:22:09 1995 Page 6
Area Percent Report -- Sorted by Signal Information from Data File: '
File : C:\HPCHEM\1\ DATA \EM31489C.D Operator : Marti Acquired : 13 Mar 95 5:43 pm using AcqMethod EM31492 Srmple Name: 0395-10c Misc Info : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M Retention Time Area Area % Ratio %
Total Ion Chromatogram 1.721 821890045 18.718 100.000 2.114 300326874 6.840 36.541 2.298 158600637 3.612 19.297 2.704 112336148 2.558 13.668 2.862 122737093 2.795 14.934 2.990 316909496 7.217 38.559 3.332 69971591 1.594 8.513 3.613 33712141 0.768 4.102 3.835 12728023 0.290 1.549 4.230 9625066 0.219 1.171 4.781 16354232 0.372 1.990 5.117 157545313 3.588 19.169 5.528 8532450 0.194 1.038 6.312 16036271 0.365 1.951 6.792 43810533 0.998 5.330 6.940 17261708 0.393 2.100 7.111 69710020 1.588 8.482 7.373 50084371 1.141 6.094 7.845 69668524 1.587 8.477 8.618 71549420 1.629 8.705 8.927 29250962 0.666 3.559 9.102 65942966 1.502 8.023 9.335 87567361 1.994 10.654 9.771 9204238 0.210 1.120 9.917 45940255 1.046 5.590 10.154 17166276 0.391 2.089 10.357 37744745 0.860 4.592 10.664 20374939 0.464 2.479 10.819 21206353 0.483 2.580 10.944 18020880 0.410 2.193 -
11.271 287131347 6.539 34.935 11.977 27633649 0.629 3.362 12.234 57054656 1.299 6.942 12.579 51599335 1.175 6.278 13.063 20024066 0.456 2.436 .
C:\HPCHEM\1\ DATA \EM31489C.D Wed Mar 22 13:42:03 1995 Page 1
I Area Percent Report -- Sorted by Signal Information from Data File:
File : C:\HPCHEM\1\ DATA \EM31489C.D
. operator : Marti Acquired : 13 Mar 95 5:43 pm using AcqMethod EM31492 Sample Name: 0395-10c Misc Info : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M Retention Time Area Area % Ratio %
13.469 74512920 1.697 9.066 13.666 36032528 0.821 4.384 14.286 16296657 0.371 1.983 14.830 18406172 0.419 2.239 15.331 32859064 0.748 3.998 15.591 16714212 0.381 2.034 15.863 51770250 1.179 6.299 16.089 33331949 0.759 4.056 16.365 29884681 0.681 3.636 17.049 12493092 0.285 1.520 17.751 11993923 0.273 1.459 18.027 5185339 0.118 0.631 18.357 86414878 1.968 10.514 18.497 59421295 1.353 7.230 18.757 22689090 0.517 2.761 19.111 26208932 0.597 3.189 19.614 31718263 0.722 3.859 19.955 31336506 0.714 3.813 20.265 31003904 0.706 3.772 20.413 7715078 0.176 0.939 20.733 8419624 0.192 1.024 20.893 35383773 0.806 4.305 '
21.156 147259350 3.354 17.917 21.905 18115216 0.413 2.204 22.083 122405471 2.788 14.893 22.433 9097099 0.207 1.107 27.642 62267663 1.418 7.576 27.861 69959439 1.593 8.512 28.098 6788416 0.155 0.826 C:\HPCHEM\1\ DATA \EM31489C.D Wed Mar 22 13:42:05 1995 Page 2
p 0 ,' . .
.r Area Percent Report -- Sorted by-Signal
~
, cInformation from Data File: .
' File. : C:\HPCHEM\1\ DATA \EM31489C.D Operator : Marti
- .JAcquired - : 13 . Mar.95 5:43.pm using AcqMethod EM31492 S;mple Name:~ 0395-10c-
- Misc Info- :-Pyrolysis of thermolag~ samples
'Via1 Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M' Retention Time Area Area % Ratio %
55.00 amu 1.795 3108452 3.334 3.897 1.954 4794129 5.142 6.010 2'.306 2078782 2.230 ' 2.606 2.859 79772053 85.561 100.000 3.331 3480517 3.733 -4.363 69.00 amu 2.123 5240577 9.631. 11.015 2.989 47651187 87.437 100.000 3.824 1597664 2.932 3.353 l
i
)
l l
l l
- i C:\HPCHEM\1\ DATA \EM31489C.D Wed Mar 22 13:46:05 1995 Page 1
_ - . - ~ . - - . _ _ _ _ - - _ _ . - - . _ - . . _ _ - - -
,. . i I
File : C:\HPCHEM\1\ DATA \EM31489D.D '
Operator : Marti -
Acquired : '14 Mar 95 9:48 am using AcqMetho_d EM31492 >
~ Instrument : 5972 - 33 . .;
Sample Name: 0395-10d .
Misc Info : Pyrolysis of thermolag samples ]
Vial Number: 1 e' . '2E7 ;
' AbHTdKnce . Zi-~EM314 5 so. D i
e L
6500000." .
. 3 ; !
N I ' l 6000000 l b
- 5500000 l 3 5000000d l!
1 9
q i
4500000.3 ,
c '
jf 4000000J r
. i 4 !
3500000q ;
i .!
3000000.j !
q tt 3 e
! lI
'2500000_ !!
I fl r
l t 2000000
.i i .i 1500000J;6 I' '
,i !
l 1000000.' j j i -
3 1 [
- i ; '
i 500000_ l l k !. '
i O
L (.s) b/$ #.UJme.]
., [ho)q.L .
,1, Time--> 5.00 10 . 0'O .' 15.00 20.00 25l00 30.00 i
r .
File : C:\HPCHEM\1\ DATA \EM31489D.D .
Operator : Marti -
Acquired l
- 14. Mar 95 9:48 am using AcqMethod EM31492 i Instrument : 5972 - 33 , .!
Sample Name: 0395-10d l Misc Info : Pyrolysis of thermolag samples Vial Number: 1 !,
FIGURE 8 Kbundance Ion 55.00 (54.70 to 55.70) : EM31489D.D '
250000a 2.'86 , !
t i
200000 4 h' t
I i l#
, i
- e i
l'
- 150000_ l l t i
.i f 100000.1 i
~
- i. :
1 '! 3.98 j 50000_
' 3 . 87 I
3.46 4.13
]
0 ^ '
Time--> 1.00 2.00' 3.00 4.'00 5.'00 f AbunTance Ion 69.00 (68.70 to 69.70): EM31489D.D !
j 250000q i
l . 1 j j 2.98 200000 '
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6
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f
. q
.,.Infe,rmationifrom Dr.to Filo:: -
1
~ Filo_. !:.C:\HPCHEM\1\ DATA \EM31489D.D
. . Operator: 2: Marti~-
Acquired. : 14 Mar 95 9:48-am using.AcqMethod.EM31492-SCmple-Name: 0395-10d-Misc Info .: Pyrolysis of thermolag samples- 'i
%; ~ Vial Number: 1- l
[S;archLibraries: C:\ DATABASE \NBS75K.L Minimum ^ Qual'ity: 0
.i
- Unknown Spectrum
- Apex .
, , Integration.Params: AutoIntegrate Pk# RT' Area %L Library /ID- Ref# .CAS# ' Qual' ;
i
~
1 1.72 33.48 C:\ DATABASE \NBS75K.L. j No matches found' ;
2 2.30 2.00'C:\ DATABASE \NBS75K.L 2-Propanol, 1-amino-353 000078-96-6 32 !
Ethanol,-2-[(1-methylene-2-propeny 2893 038653-51-9 10^
3-Hexyne-2,5-diol 64117 003031-66-1 9
- 3 '2.98 4.73 C:\ DATABASE \NBS75K.L .
- 2-Propenoic: acid, 2-methyl , 3-hyd '8333 002761.09-3;40s 1 2-Butenoic acid,. methyl ester, (E)- :63312 000623-43-8-'27' 2-Butenoic acid, methyl ester,.(E) .1458-000623-43-8 27 '?
4 3.51 2.78'C:\ DATABASE \NBS75K.L 1-Penten-3-yne, 2-methyl- 62647 000926-55-6 50 i 1-Decyne- 65924 000764-93-2 43 f 1-Decyne .7027 000764-93-2 43- 1 5 3.86 0.52 C:\ DATABASE \NBS75K.L 2-Octene 63998 000111-67-1 38- .
2-Octene, (Z) - 64044.007642-04'-8 35 [
Cyclohexane, 1,2-dimethyl , cis- 63989 002207-01-4 25 i 6- 3.99 1.04 C:\ DATABASE \NBS75K.L !
Cyclohexane, 1,2-dimethyl ,-cis- 2653 002207-01-4 50 !
4-Octene, (E)- 64040 014850-23-8-50 Cyclohexane, 1,2-dimethyl , cis- 63989 002207-01-4 50 i 7 5.03 4.25 C:\ DATABASE \NBS75K.L- __
Pyridine, 3-methyl- :63044 000108-99-6 95 i Pyridine, 3-methyl- 981 000108-99-6'95- !
Pyridine, 3-methyl- 63046 000108-99-6 91 -
8 5.83 6.01 C:\ DATABASE \NBS75K.L !
Phenol 63071 000108-95-2.95~ !
Phenol 63072 000108-95-2'94 !
Phenol 63069 000108-95-2-91 l 9 6.01 3.13 C:\ DATABASE \NBS75K.L !
Phenol 63072 000108-95-2 91 !
Phenol 63071 000108-95-2 90- l Phenol 63069 000108-95-2-90 ' !,
j C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 14:01:14 1995- Page 1 !
,,Pk#,.RTl Argot Librcry/ID . Raf# CAS# Qunl.
10- 6.30 2.09 C:\ DATABASE \NBS75K.L Phenol 63071 000108-95-2 91 Phenol 63070 000108-95-2 83 Phenol ,
63072 000108-95-2 78 ;
~
11 _6.81 1.38 C:\ DATABASE \NBS75K.L Pyridine, 3-ethyl- '63740 000536-78-7 91 i Pyridine, 3-ethyl- 63739 000536-78-7 58 i Pyridine, 2,6-dimethyl- 2054 000108-48-5 38 12 6.95 0.76 C:\ DATABASE \NBS75K.L Phenol 63070 000108-95-2 47 2,4-Heptadien-6-ynal, (E,E)- 2017 007200-04-6 38 Phenol 63071 000108-95-2 35 13 .7.10 4.18 C:\ DATABASE \NBS75K.L Pyridine, 3,5-dimethyl- 63720 000591-22-0 95 l Pyridine, 3,5-dimethyl- 2047 000591-22-0 93 l Pyridine, 2,5-dimethyl- .2046 000589-93-5 93 14 7.85 0.57 C:\ DATABASE \NBS75K.L Benzenemethanamine, N-methyl- 3847 000103-67-3 42 Phenol 63070 000108-95-2 35-Phenol 63069 000108-95-2 35 15 8.46 2.16 C:\ DATABASE \NBS75K.L Phenol, 3-methyl- 63780 000108-39-4 96 Phenol, 3-methyl- 63781 000108-39-4 94 Phenol, 4-methyl- 63786 000106-44-5 89-16 8.63 1.27 C:\ DATABASE \NBS75K.L ;
Pyridine, 2,3,6-trimethyl- 3822 001462-84-6 90 Benzyl Alcohol 2119 000100,-51-6 70 Benzyl Alcohol 63783 000100-51-6 55 17 8.92 0.84 C:\ DATABASE \NBS75K.L Aniline, N-methyl- 63713 000100-61-8 81 Pyridine, 3-ethyl-5-methyl- 3821 003999-78-8 60 Benzenamine, 3,4-dimethyl- 3838 000095-64-7 60 18 9.11 1.43 C:\ DATABASE \NBS75K.L Pyridine, 5-ethenyl-2-methyl- 3656 000140-76-1 87 Bicyclo [4.1.0]hept-4-en-3-ol, 3,7, 10368 004017-81-6 38 Benzene, methyl (1-methylethyl)- 6208 025155-15-1 38 19 9.35 3.58 C:\ DATABASE \NBS75K.L Benzenamine, 4-propoxy . 10015 004469-80-1 53 ,
2 (1H) -Pyridinone, 1-methyl- 63813 000694-85-9 52 1H-Pyrrole-2-carboxaldehyde, 1-met 63814 001192-58-1 43-20 9.92 1.10 C:\ DATABASE \NBS75K.L 1H-Pyrrole, 2,3,4,5-tetramethyl- 4056 001003-90-3 76 Phenol, 2,6-dimethyl- 64673 000576-26-1 35 Benzene, 1-methoxy-4-methyl- 64711 000104-93-8 27 C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 14:01:38 1995 Page 2
L Pk#. RT Arca% Library /ID
- Ref0 CAS# Quni 21 10.65 0.66 C:\ DATABASE \NBS75K.L Xanthine, 1,3 -dipropyl [4 - [ . be ta 61073 000000-00-0 22 Phenol, 3 - (2-aminoethyl) - 6755 000588-05-6 22 Benzyl Alcohol -
63785 000100-51-6 18 22 11.09 0.46 C:\ DATABASE \NBS75K.L Oxetane, 2-propyl- 1554 004468-64-8 30 Phosphine, diphenyl- 19504 000829-85-6 27 1,4-Benzenediamine 63757 000106-50-3 27 23 11.40 0.96 C:\ DATABASE \NBS75K.L Ethanol, 2-phenoxy- 6911 000122-99-6 83 Ethanol, 2-phenoxy- 65895 000122-99-6 42 Ethanone, 1-(8-hydroxy-5-quinoliny 57998 057130-91-3 27 24 11.97 0.33 C:\ DATABASE \NBS75K.L 3-Pyrrolidinecarboxylic acid, 1-me 8140 042346-68-9 27 Pentanedioic acid, 2-methyl , mono 12301 072088-36-9 27 Butanamide, N-hexyl- 15488 010264-17-2 25 25 12.58 0.58 C:\ DATABASE \NBS75K.L Pentanedioic acid, diethyl ester 19778 000818-38-2 49 Pentanedioic acid, diethyl ester 69156 000818-38-2_47 Pentanedioic acid, diethyl ester 69155 000818-38-2 38 26 13.47 0.97 C:\ DATABASE \NBS75K.L i 3 -Azabicyclo [3 . 2.1) octane , 9. beta. 11192 000000-00-0 35 l 2H-Quinolizin-3-ol, octahydro , tr 11200 015769-36-5 32 Piperidine, 4-methyl- 63292 000626-58-4 27 i
1 27 13.68 0.67 C:\ DATABASE \NBS75K.L Pyridinium, 1- (1-carboxyethyl) , h 9987 036880-54-3 38 Benzenemethanol, 4-hydroxy . alpha. 14272 000094-07-5 32 2-Cyclohexen-1-one, 4- (3-hydroxy-1 24937 052210-15-8 30 28 16.05 0.26 C:\ DATABASE \NBS75K.L Hydrazine, butyl , oxalate (1:1) 17011 006629-62-5 47 Propanamide
~
62531 000079-05-0 46 Hydrazine, (1,1-dimethylethyl) , m 4094 007400-27-3 40 29 16.36 0.27 C:\ DATABASE \NBS75K.L Ethanol, 2- (2-phenoxyethoxy) - 18349 000104-68-7 78 Ethanol, 2- (2-aminoethoxy) - 1965 000929-06-6 32 Carbamic acid, 1-methylethyl ester 1812 001746-77-6 22 30 18.34 0.35 C:\ DATABASE \NBS75K.L 2,5,8,11,14-Pentaoxapentadeccne 70591 000143-24-8 43 2-Pentanone, 5-methoxy- 64282 017429-04-8 43.
2-Butanol, 1-chloro- 2078 001873-25-2 38 31 18.49 0.20 C:\ DATABASE \NBS75K.L 1-Butanol, 4-ethoxy- 3538 000111-73-9 38 Propane, 1-ethoxy-2-methyl- 63543 000627-02-1 27 2-Pentanone, 5-methoxy- 64282 017429-04-8 25 4
C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 14:02:11 1995 Page 3
, .jPk#. RT Aract Librnry/ID - Raf# CAS# Qual 32 20.17 0.39-C:\ DATABASE \NBS75K.L 1,5-Diphenyl-2H-1,2,4-triazoline-3 34508 005055-74-3 47 1, 3 -Diphenyl- (4H) 1, 2, 4 - triaz oline - 34507 000000-00-0 47 4 -Hexen- 2 -yn one , 1-phenyl (1. 34549 029743-43-9 37
~
33 21.40 0.33 C:\ DATABASE \NBS75K.L 2 - Amino (0-me thoxyphenyl) propane 13749 074702-94-6 50 2-Aminonon.-decane 40006 031604-55-4 47 Benzeneethanamine, N-methyl- 65605 000589-08-2 47
-34 21.90 0.37 C:\ DATABASE \NBS75K.L Butanamide 62880 000541-35-5 47 Hydrazine, 2-ethyl-1,1-dimethyl- 829 029559-82-8 38 2-Propanol, 1 - [1-methyl (2 -prope 68438 055956-25-7 38 35 22.08 6.28 C:\ DATABASE \NBS75K.L 2 - Propanol , 1 - [1 - me t hyl ( 2 -prope 68438 055956-25-7 50 2,5,8,11,14-Pentaoxapentadecane 70591 000143-24-8 47 1-Propanol, 2- (2-hydroxypropoxy) - 6086 000106-62-7 47 36 22.79 0.94 C:\ DATABASE \NBS75K.L 2-Propanol, 1,l'-[(1-methyl-1,2-et 20630 001638-16-0 43 Butanamide 755 000541-35-5 43 1-Butanol, 4-ethoxy- 3538 000111-73-9 42 37 23.01 0.48 C:\ DATABASE \NBS75K.L N-Desmethyldiphenhydramine 32185 000000-00-0 35 N-Methyl-2-benzyloxyethylamine 13744 071126-62-0 35 6H-Purin-6-one, 2- (dimethylamino) - 17389 001445-15-4 14 38 23.13 0.69 C:\ DATABASE \NBS75K.L 2, 4, 6, 8, 9,10 -Hexathiatricyclo [3 . 3 . 46703 057289-12-0 14 N-Isobutyl ( 3,4 -me thylenedioxyp 49818 054794-74-0 9 39 24.31 0.37 C:\ DATABASE \NBS75K.L Methanone, bis (4-phenoxyphenyl)- 50989 014984-21-5 33 Fumarylacetone diethoxime mono-TMS 44733 000000-00-0 23 5-Ethyl-5-(2-methylallyl)-2-thioba 29018 000115-56-0 23 40 25.26 1.85 C:\ DATABASE \NBS75K.L Butanamide, 3-methyl- 1621 000541-46-8 46 1-Propanol, 2- (2-methoxypropoxy) - 9232 013588-28-8 43 2-Butanol, 3-methoxy- 1908 053778-72-6 38 41 27.86 3.97 C:\ DATABASE \NBS75K.L Octicizer 50542 001241-94-7 64 7-Amino-2,3-dihydro-5-phenyl-1H-1, 34112 004928-02-3 59 2 - ( 4 - Cyanophenyl) dime t hylaminom 34091 000000-00-0 45, 1
42 28.09 0.51 C:\ DATABASE \NDS75K.L Benzene, 1,3-bis (1,1-dimethylethyl 69254 001014-60-4 7 43 29.00 0.37 C:\ DATABASE \NBS75K.L l Benzene, 1,1 ' , l ' ' - [1- (bromome thyl) 53419 055373-93-8 35 l 2,5-Dimethoxy-4-(methylthionyl) amp 35298 000000-00-0 28 l 2,5-Dimethoxy-4-(methylthionyl) amp 35296 000000-00-0 28 l C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 14:02:36 1995 Page 4 J
- ,j Pk# .. RT. TAront Library /ID .
^
Rsf#
-' .CAS# Quni- l
[- ,
- 44 31.61 0.24 C:\ DATABASE \NBS75K.L .
Phosphoric acid, ' tris (3-methylphen 51124:000563-04-2.99 ' '
Phosphoric acid, tris (methylphenyl 51123 001330-78-5 95 l Phosphoric acid, tris (methylphenyl 73955 001330-78-5 93 i 45 32.25 0.22 C:\ DATABASE \NBS75K.L .
l Phosphoric acid, tris (3-methylphen- 51124 000563-04-2 98 Phosphoric- acid, tr.'.s (methylphenyl' 73955 001330-78-5^93' Phosphoriciacid, tris (4-methylphen - 51126 000078-32-0 93 1
i
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l l
i
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l 1 1
1 1
C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 14:02:41 1995 Page 5. j
j
- =
Area Percent Report -- Sorted by Signal Information from Data File:
File : C:\HPCHEM\1\ DATA \EM31489D.D Operator : Marti i Acquired : 14 Mar 95 9:48 am using AcqMethod EM31492 {
S mple Name: 0395-10d '
Misc Info : Pyrolysis of thermolag samples Vial Number: 1 l CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M l
Retention Time Area Area % Ratio % 1 Total Ion Chromatogram 1.720 864904975 33.479 100.000 2.304 51793128 2.005 5.988 2.983 122153025 4.728 14.123 l 3.501 71712443 2.776 8.291 3.863 13306795 0.515 1.539 3.989 26899765 1.041 3.110 5.036 109805770 4.250 12.696 5.829 155220471 6.008 17.947 6.014 80956508 3.134 9.360 6.293 53955591 2.089 6.238 6.815 35678664 1.381 4.125 6.947 19606494 0.759 2.267 7.100 107907648 4.177 12.476 7.847 14667667 0.568 1.696 8.461 55883243 2.163 6.461 8.638 32911851 1.274 3.805 8.923 21737456 0.841 2.513 9.106 37042946 1.434 4.283 9.350 92469908 3.579 10.691 9.923 28436161 1.101 3.288 10.653 16940600 0.656 1.959 11.094 11897229 0.461 1.376 11.402 24821299 0.961 2.870 11.975 8412130 0.326 0.973 12.580 14907776 0.577 1.724 13.468 25174823 0.974 2.911 13.674 17246015 0.668 1.994 16.058 6750958 0.261 0.781 16.364 6989122 0.271 0.808 18.349 9031888 0.350 1.044
~
18.491 5086110 0.197 0.588 20.168 10025571 0.388 1.159 21.402 8646248 0.335 1.000 21.904 9467345 0.366 1.095 22.081 162321953 6.283 18.768 C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 13:47:14 1995 Page 1
i 1
- *. L -
Area Percent Report -- Sorted by Signal
. i 1
Information from Data File: !
File : C:\HPCHEM\1\ DATA \EM31489D.D i
operator : Marti .
Acquired : 14 Mar 95 9:48 am using AcqMethod EM31492 i 1Srmple Name: 0395-10d r Misc Info : Pyrolysis of thermolag samples Vial Number: 1 -
CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M ;
Retention Time Area Area % Ratio % 5 22.794 24175370 0.936 2.795 23.004 12353747 0.478 1.428 1 23.132 17702998 0.685 2.047 24.304 9447188 0.366 1.092 25.265 47728988 1.848 5.518. ,
27.860 102543144 3.969 11.856 ;
28.092 13213616 0.511 1.528 28.993 9517746 0.368 1.100 31.611 6295834 0.244 0.728 32.252 5685641 0.220 0.657-l i
I
~
t C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 13:47:16 1995 Page 2
~ . _ . . . . - . - - - - - - - - -
n Area Percent Report -- Sorted by Signal Information from Data File:
File : C:\HPCHEM\1\ DATA \EM31489D.D
' Operator : Marti-Acquired : 14' Mar 95 9:48 am using AcqMethod EM31492 Sample _Name: 0395-10d Misc Info : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M I
, Retention Time Area Area % Ratio %
55.00 amu 2.858 14232183 69.286 100.000 3.459 630852 3.071 4.433 3.871 1581982 7.701 11.116 3.984 2385406 11.613 16.761 4.126 993505 4.837 6.981 5.618 227254. 1.106 1.597 5.731 405181 1.973 2.847 5.842 84900 0.413 0.597 69.00 amu 2 . 3 '/ J 747241 5.567 6.027 2.984 12397983 92.361 100.000 3.992 278214 -2.073 2.244 C:\HPCHEM\1\ DATA \EM31489D.D Wed Mar 22 13:47:37 1995 Page 1
}
t
~
t I
i
- File : C:\HPCHEM\1\ DATA \EM31489E.D
- Operator : Marti Acquired : 14 Mar 95 8:57 am using AcqMetho,d EM31492 l
-i Instrument.: 5972 - 33 . (
Sample Name: 0395-10e Misc Info : Pyrolysis of thermolag samples l Vial Number: 1 :
I
- FIGURE 9 ;
- Abundance TIC: EM31459E.D
,2.4e+07j 4 I
i l2.2e+07-i 2e+07- ,
f 1.8e+07- I I
i 1.6e+07- i :
l;
}
1.4e+07- +
l f j 1.2e+07- .i i n ,
E- t i
le+07_ !! l t 6 t
8000000- ll i p
.1 j t -!
6000000_ .
]
4000000_ l
\ -
. i ) i
. li i
,2000000g g':,(gj4>
i i dh ! , tdt,m .'.,1 '
Time-->
0u.
5.00 10.00 15.00 20.00 25.00 k.YWiJ._.~._
30.00 !
= -
v
e File : C:\HPCHEM\1\ DATA \EM31489E.D i Operator : Marti -
l Acquired : 14 Mar 95 8:57 am.using AcqMethod EM31492 !
Instrument : 5972 - 33 , i Sample Name: 0395-10e Misc Info : Pyrolysis of thermolag samples Vial Number: 1 FIGURE 10 Abundance Ion 55.00 (54.70 to 55.70): EM3T4T9E.D ; .
2 1600002 2.'86
, 2 y l 1
140000.b' !
! j l !
4 i !
1200004 I f
i 1
l i !
100000 I 80000) ;
i 60000.3 ! .
i 1
1
') ,
i 4
i i 3.41 :
'/
0
\
(l r Time--> 1.00 2.00 3.00 4.00 5.00 AbFndEnce Ion 69.00 (68.70 to 69.70): EM31459E.D !
160000; l 2
1400001 l
120000; 2.99 !
3 .
1000002 4
) !
- ili !
t 800003 !! !
I !
} 60000 _* l
, 400002 3, l
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k .
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1 Time--> 1.00 2.00 3.00 4.'00 5.00 !
l l
.* Info.rmation from D:to Filo: -
- Filo : C:\HPCHEM\1\ DATA \EM31489E.D Operator : Marti Acquired : 14 Mar 95 B:57 am using AcqMethod EM31492 S mple Name: 0395-10e Misc Info : Pyrolysis of thermolag samples Vial Number: 1 ,'
Scarch Libraries: C:\ DATABASE \NBS75K.L Minimum Quality:- 0 Unknown Spectrum: Apex Integration Params: AutoIntegrate Pk# RT Areat Library /ID Ref# CAS# Qual t 1 1.73 4.76 C:\ DATABASE \NBS75K.L No matches found 2 1.92 0.83 C:\ DATABASE \NBS75K.L No matches found 3 2.11 0.39 C:\ DATABASE \NBS75K.L Furan, 2,5-dihydro- 62434 001708-29-8 58
- 2-Propenal, 2-methyl- 62430 000078-85-3 55 Vinyl Ether 62451 000109-93-3 50 4 2.30 0.31 C:\ DATABASE \NBS75K.L Furan, 2-methyl- 463 000534-22-5 91 Furan, 2-methyl- 62666 000534-22-5 81 Furan, 2-methyl- 62665 000534-22-5 74 5 2.88 0.12 C:\ DATABASE \NBS75K.L 2-Propenoic acid, ethyl ester 1461 000140-88-5 41 2-Propenoic acid, ethyl ester 63319 000140-88-5 38 2-Propenoic acid, ethyl ester 63318 000140-88-5 38 6 2.99 0.51 C:\ DATABASE \NBS75K.L 2-Butanamine, 3-methyl- 774 000598-74-3 43 2-Octanamine 65170 000693-16-3 42 l 2-Propanamine 105 000075-31-0 40 1
7 3.41 0.14 C:\ DATABASE \NBS75K.L l 1H-1,2,4-Triazole-3-carboxaldehyde 2402 056804-98-9 10 !
2-Oxetanone, 4,4-dimethyl- 1450 001823-52-5 10 i Cyclopentane, 1,1-dimethyl- 1333 001638-26-2 9 l l
8 3.48 0.30 C:\ DATABASE \NBS75K.L !
1-Penten-3-yne, 2-methyl- 62647 000926-55-6 50 !
Metronidazole 15396 000443-48-1'38 '
1H-Pyrrole, 1-methyl- 62656 000096-54-8 38-9 5.03 0.83 C:\ DATABASE \NBS75K.L Pyridine, 3-methyl- 63044 000108-99-6 94 Pyridine, 3-methyl- 981 000108-99-6 94 '
Pyridine, 3-methyl- 63045 000108-99-6 94 C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:34:33 1995 Page 1
.Pk#;4RT.
Ar:0% Library /ID'. R0f# CAS# Quel 10 6.81 0.10 C:\ DATABASE \NBS75K.L Phenol 63072 000108-95-2 78 Phenol -
1010 000108-95-2 78 Phenol , 63069 000108-95-2 60 11 '6.95 0.08 C:\ DATABASE \NBS75K.L Pyrimidine, 5-methyl- 1004 002036-41-1 47 Phenol 63072 000108-95-2 46 Phenol 63071 000108-95-2 46 i 12 7.11 0.56 C:\ DATABASE \NBS75K.L '
Pyridine, 2,4-dimethyl- 63733 000108-47-4 94
- Pyridine, 2,5-dimethyl- 2046 000589-93-5 93 ;
63719 000589-93-5 91 Pyridine, 2,5-dimethyl-13 7.31 0.02 C:\ DATABASE \NBS75K.L Pyridine, 2,3-dimethyl- 63735 000583-61-9 92 Pyridine, 2,6-dimethyl- 2054 000108-48-5 78 Phenol 63072 000108-95-2 70 14 8.62 0.12 C:\ DATABASE \NBS75K.L Pyridine, 2,3,5-trimethyl- 3839 000695-98-7 93 Pyridine, 2,3,6-trimethyl- 3822 001462-84-6 87 Pyridine, 2,3,6-trimethyl- 64607 001462-84-6 87 15 8.93 0.12 C:\ DATABASE \NBS75K.L ;
Aniline, N-methyl- 63713 000100-61-8 83 :
Benzenamine, 2-methyl- 63716 000095-53-4 64 Phenol, 3-methyl- 63780 000108-39-4 59 16 9.11 0.34 C:\ DATABASE \NBS75K.L 4-Aminostyrene 3652 001520-21-4 81 Pyridine, 5-ethenyl-2-methyl- 3656 000140-76-1 64 Benzene, isocyanato- 3642 000103-71-9 49 17 9.40 0.73 C:\ DATABASE \NBS75K.L Benzenamine, 4-propoxy- 10015 004469-80-1 59 I 2,3-Pyridinediamine 2194 000452-58-4 58 i Phenol, 3-amino- 2210 000591-27-5 52 18 9.96 0.05 C:\ DATABASE \NBS75K.L 1H-Pyrrole, 2,3,4,5-tetramethyl- 4056 001003-90-3 70 .
Pyridine, 4-ethyl , 1-oxide 4042 014906-55-9 30 l 1H-Pyrrole, 3-ethyl-2,5-dimethyl- 4061 069687-78-1 25 ;
19 11.61 0.29 C:\ DATABASE \NBS75K.L Ethanol, 2-phenoxy- 6911 000122-99-6 96 !
Ethanol, 2-phenoxy- 65894 000122-99-6 90 Ethanol, 2-phenoxy- 65895 000122-99-6 90' ;
20 16.49 0.07 C:\ DATABASE \NBS75K.L I Phenol, 4-(1,1,3,3-tetramethylbuty 24424 000140-66-9 93 Phenol, 4- (2,2,3,3-tetramethylbuty 24409 054932-78-4 80 Phenol, 4-(1,1,3,3-tetramethylbuty 70047 000140-66-9 80 C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:34:53 1995 Page 2
..Pk#..RT Arant Library /ID -
R3f# CAS# Quni 21 17.55 0.47 C:\ DATABASE \NBS75K.L 1-Propanol, 2- (2-hydroxypropoxy) - 6086 000106-62-7 38 2-Propanol, 1,l'-[(1-methyl-1,2-et 69286 001638-16-0 38 Butanoic acid, 2-hydroxy , methyl 3508 029674-47-3 35 22 17.73 0.39 C:\ DATABASE \NBS75K.L 2,5,8,11,14-Pentaoxapentadecane 28004 000143-24-8 38 2 - Propanol , 1- ( 2 -me thoxypropoxy) - 9233 013429-07-7 35 2-Butanol, 1-chloro- 2078 001873-25-2 35 23 18.58 0.08 C:\ DATABASE \NBS75K.L 1-Propanol, 2-(2-hydroxypropoxy)- 6086 000106-62-7 47 2,5,8,3.1,14-Pentaoxapentadecane 70592 000143-24-8 47 2 Dropanol, 1, l ' - [ (1-methyl-1,2-et 20630 001638-16-0 47 24 18.96 0.08 C:\ DATABASE \NBS75K.L Phenol, nonyl- 70560 025154-52-3 95 4-Nonylphenol 70559 000104-40-5 50 Benzeneacetonitrile, 3-fluoro- 65593 000501-00-S 38 25 19.07 0.05 C:\ DATABASE \NBS75K.L Phenol, nonyl- .70560 025154-52-3 93 4-Nonylphenol 70559 000104-40-5 70 Benzeneacetonitrile, 3-fluoro- 65593 000501-00-8 46 26 19.14 0.09 C:\ DATABASE \NBS75K.L Phenol, nonyl- 70560 025154-52-3 76 4-Nonylphenol 70559 000104-40-5 45 ,
Benzeneacetonitrile, 3-fluoro- 6265 000501-00-8 38 '
27 19.70 0.70 C:\ DATABASE \NBS75K.L Mandelic acid, 3,4-dimethoxy , met 29038 002911-73-1 25 i Benzene, dichloromethyl(1-methylet 22825 054889-89-3 15 l 1-Hydroxy-4-hydrazonomethyl-2,2,5, 22779 051973-32-1 15 28 19.86 0.24 C:\ DATABASE \NBS75K.L Tetradecanoic acid 70842 000544-63-8 95 Tetradecanoic acid 29646 000544-63-8 95 Tetradecanoic acid 70841 000544-63-8 95 29 19.98 0.57 C:\ DATABASE \NBS75K.L (11H) Pyrido [3 ' ,2 ' : 4,5] imidazo [2,1- 34486 000000-00-0 38 4-Hexen-2-yn-1-one, 1-phenyl (1- 34549 029743-43-9 37 trans-2,4,5-Trimethoxf . beta.-meth 34473 000000-00-0 25 30 20.02 0.43 C:\ DATABASE \NBS75K.L 1, 3 -Diphenyl- ( 4 H ) 1, 2, 4 - tria zoline- 34507 000000-00-0 47 1,5-Diphenyl-2H-1,2,4-triazoline-3 34508 005055-74-3 43 4-Hexen-2-yn-1-one, 1-phenyl-5-(1- 34549 029743-43-9 37-
]
31 20.11 1.68 C:\ DATABASE \NBS75K.L 1-Methyl (4 -nitrophenyl ) benzimid 34504 000000-00-0 32 6 - ( 2 - Formylhydrazino) -N, N ' -bis (iso 34454 084305-82-8 14 Benzaldehyde, 4- [ [4 - (dimethylamino 34523 000000-00-0 14 C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:35:17 1995 Page 3
- ,.Pk#3 RT Arsc% Library /ID -
Raf# CAS#. Quni 32 20.45- 0.16 C:\ DATABASE \NBS75K.L 1-Propene, 3,3'-thiobis- 64133 000592-88-1 22 Nordextrorphan .
32550 000000-00-0 18 Ethanol, 2- [2- (2-phenoxyethoxy) eth 29066.007204-16-2:14 133' 20.81 2.82 C:\ DATABASE \NBS75K.L Benzenemethanamine , - N- [ [ [4 -hydroxy 34946 000000-00-0 11 Thiourea, N-(2-methylpropyl)-N'-ph 24826 016275-53-9 10 Thiourea, N- (1-methylpropyl) -N' -ph 24827 015093-37-5 10 34 21.09 2.85 C:\ DATABASE \NBS75K.L Y' 1 3-Dioxolane, 2- (4-methoxyphenyl) 21216.000000-00-0 43
.Silanol, trimethyl , benzoate 69391 002078-12-8 35 Silanol, trimethyl ,. benzoate 69390 002078-12-8 35 35 21.46 0.65 C:\ DATABASE \NBS75K.L l ' H- Androst eno [17,16 -g] indol- 3 54335 056196-20-4 27 2 - (4 - (Dimethylamino) naphthyl) na 46514 000000-00-0 14 Phosphonofluoridothioic hydrazide, 11251 036267-52-4 14 36 21.49 0.56 C:\ DATABASE \NBS75K.L l ' H- Androst-16 -eno [17,16-b] indol- 3 54336 039987-70-7 12 2, 4 , 6, 8 , 9,10 -Hexathiatricyclo [3 . 3 . 46703 057289-12-0 10
~
Phosphonofluoridothioic hydrazide, 11251 036267-52-4 10 37 '21.68 0.78 C:\ DATABASE \NBS75K.L 5,9-Methanobenzocycloocten-5(1H)-o 38886 016004-84-5 47' Phenol, 4,6-di(1,1-dimethylethyl)- 27703 000616-55-7 43 Eutylated Hydroxytoluene 70551 000128-37-0 38 38 22.18 19.87 C:\ DATABASE \NBS75K.L 2-Butanol, 3-methoxy- 1908 053778-72-6 46 Propane, 1,2-dimethoxy- 63620 007778-85-0 46 1-Chloro-2-ethoxyethane 2079 000628-34-2 43 39 22.25 3.07 C:\ DATABASE \NBS75K.L 1-Chloro-2-ethoxyethane _2079 000628-34-2 46 2-Butanol,-3-methoxy- 1908 053778-72-6-43 l L Propane, 1,2-dimethoxy- 63620 007778-85-0 43 1
40 22.33 7.69 C:\ DATABASE \NBS75K.L' Methane, diethoxy- 63623 000462-95-3 43 2-Butanol, 3-methoxy- 1908 053778-72-6 38 Ethane, 1-bromo-2-ethoxy- 10074 000592-55-2 37 41 22.48 1.07 C:\ DATABASE \NBS75K.L Tricyclo [4.3.1.13,8]undecane-3-car 24919 031061-61-7 38' 1,2-Benzenedicarboxylic acid, dipr 33901'000131-16-8 35 Dibutyl phthalate 72212 000084-74-2 35" 42 22.55 1.19 C:\ DATABASE \NBS75K.L Stannane, diethyldimethyl- 24682 004282-05-7 38 Silanol, trimethyl , benzoate 69391 002078-12-8 30 1,3-Dioxolane, 2- (4-methoxyphenyl) 21216 000000-00-0 27 C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:35:37 1995 Page 4
, . _ __ . . . . . __ . . _ ~
.;Pk#.,RT JAract Librcry/ID.. Raf# CAS# Quni
, 43= 22'.76- 1.72'C:\ DATABASE \NBS75K.L Propanol; 1- [1-methyl (2-prope 68438 055956-25-7 59 'l Methane, diethoxy- .
, 63623.000462-95-3 50 -
1-Propanol, 2 - (2-hydroxypropoxy) - 6086 000106-62-7 50 !
44 22.80' 1.94 C:\ DATABASE \NBS75K.L i 1-Propanol ~, 2- (2-hydroxypropoxy) - 6086 000106-62-7 Methane, diethoxy- 63623 000462-95-3 47
'2-Hexanol, 2-methyl- 64355 000625-23-0 43 i 45 22.87 0.88 C:\ DATABASE \NBS75K.L ;
2-Naphthalenemethanol, decahydro . 28201 000473-15-4H58 .
2 - Propanol , 1 - [1- me thyl ( 2 -prope . 68438 055956-25-7 43 Butane, 2-methoxy- 854 006795-87-5'38-46 23.03 1.44 C:\ DATABASE \NBS75K.L- '
6H-Purin-6-one, 2-(dimethylamino)- 17389 001445-15-4 53' 2',4'-Dimethoxy-3'-methylpropiophe 24862 077942-13-3 50 ,
Stannane, diethyldimethyl- 24682-004282-05-7 42:
- 47 23.14 1.02 C:\ DATABASE \NBS75K.L Pipercallosine [(2E,4E)-N-isobutyl 46761 083029-39-4 10 ,
7-Silabicyclo [2.2.1] hept-5-ene-2-c . 58285 056805-08-4 '9 :
.48 23.27 0.95 C:\ DATABASE \NBS75K.L-
-Quinoline, 2-phenyl- 24119-000612-96-4 38 Ethanone , 1- [4 - (hydroxymethyl) p 30459 067387-02-4 20 -
2-Phenazinecarbonitrile 24085 006479-93-2 15 49 23.47 0.54 C:\ DATABASE \NBS75K.L 8-Phenylisoquinoline 24122 070125-67-6.25 :
1- ( 2, 6 -Dime thylbicyclo [4 . 3 . 0] non-1 24398 000000-00-0 25 1 Thiazolo [5,4-d] pyrimidine, 5,7-dic 24004 013479-88-4 18 !
50 23.54 0.30 C:\ DATABASE \NBS75K.L ,
Deacetylphytuberin 34336 000000-00-0 38 l Stannane, (1,1-dimethylethyl) trict .36486 035569-21-2 35 !
Butanoic acid,-3-oxo , 1,1-dimethy 11892 001694-31-1 10- ,
51 23.63 0.49 C:\ DATABASE \NBS75K.L Cyclopentane, .1,1' - [3- (2-cyclopent 43532 055255-85-l'15 i
- 2 (1H) -Naphthalenone, octahydro-da, 28234 055332-03-1 15 ;
5,9-Dimethyl-2-(1-methylethylidene 28752 069239-72-1 14 !
52 23.69 0.48 C:\ DATABASE \NBS75K.L Cyclohexane,- (1-octylnonyl)- 73276 055124-77-1 58 ;
Hexadecane,. 2,6,10,14-tetramethyl- 72329 000638-36-8 56 t 1-Nonadecene 71890 018435-45-5 53 l 1
53 23.96 0.59 C:\ DATABASE \NBS75K.L l Eicosane 72326 000112-95-8 95 )
Heneicosane 42201 000629-94-7 95 ]
Heneicosane 72684 000629-94-7 95 l l
1 i
C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:36:29 1995 Page 5 l l
l
[Pk#;[RT Aront. Library /ID .- Raf#- CAS#' Qual !
,, p . .:
- 54- 24.12 -1.02 C:\ DATABASE \NBS75K.L Heptadecane, 3-methyl- 34812 006418-44-6-45 l 1-Octadecanethiol . 40555 002885-00-9~25 +
1,3-Dioxolane, 4-ethyl-5-octyl-2,2f 49234 038274-73-6 22 55 '24.38 1.06 C:\ DATABASE \NBS75K.L .
e Octadecane, 3-ethyl (2-ethylbuty 51003 055282-12-7 38 l Silane, [ (11-iodoundecyl) oxy] trime 51281 026305-84-0 35- i Eicosane, 9-octyl-' 53460 013475-77-9 22 l L'
56
- 24.'47 0.34 C:\ DATABASE \NBS75K.L l Octadecane, 1-chloro- 72490 003386-33-2 83 l 1-Docosene 72943 001599-67-3 74 i Acetamide, N-methyl-N- [4 - [4-meuhox 31490 000000-00-0 70 !
57 24.60 0.36 C:\ DATABASE \NBS75K.L . .
. Acetamide, N-methyl-N- [4- [4-methox 31490 000000-00-0 99 !
Octadecane, 1-chloro- 72490 003386-33-2 93 [
Cyclohexane, (1-octylnonyl)- 73277 055124-77-1 90 [
58 24.68 0.58 C:\ DATABASE \NBS75K.L . .
Acetamide, N-methyl-N- [4- [4-methox 31490 000000-00-0-93 Ethanol, 2 - [2 - [4 - (1,1, 3,3 - tetramet 41793 002315-61-9 87.
Octadecane, 1-chloro- 72490 003386-33-2 56 l 59 24.77 0.54 C:\ DATABASE \NBS75K.L !
Acetamide, N-methyl-N- [4- [4-methox 31490 000000-00-0 99 Eicosane 39862 000112-95-8 84-Octadecane 348141000593-45-3 84
- 6 0_ 24.88 0.55 C:\ DATABASE \NBS75K.L. :
Acetamide; N-methyl-N- [4- [4-methox . 31490 000000-00-0 95 !
Tridecane 6-cyclohexyl , 6-cyclohe 37071 013151-91-2;70 !
Cyclohexane, (1-octylnonyl)- 73277 055124-77-1 70 :
1 61- 24,97 0.63 C:\ DATABASE \NBS75K.L ~ I 9-Phenanthrylmethyl 3-methoxybenzo 48430 000000-00-0 23-62 25.08 0.73 C:\ DATABASE \NBS75K.L Heneicosane 72685 000629-94-7 91 Docosane 44318 000629-97-0 90 l Acetamide, N-methyl-N- [4- [4-methox 1 31490 000000-00-0 90 63 25.15 0.95 C:\ DATABASE \NBS75K.L 2-Butanol, 3-methoxy- <1908 053778-72-6 43 2-Propanol, 1- [1-methyl (2 -prope 16196 055956-25-7 38 2-Propanol, 1-methoxy-2-methyl- 1912 003587-64-2 38 64' 25.20 1.17 C:\ DATABASE \NBS75K.L -
2-Propanol, 1- [1-methyl (2 -prope 68438 055956-25-7'47-Butanamide, 3-methyl- 1621 000541-46-8 43 Propane, 1-ethoxy-2-methyl- 63544 000627-02-1 43- l 65 25.30 1.19 C:\ DATABASE \NBS75K.L 3-Heptanol, 4-methyl- 65298 014979-39-6 38 2-Hexanol, 2-methyl- 64355 000625-23-0 38 1,8-Nonanediol, 8-methyl- 16264 054725-73-4 38 C \MPCHEM\1\ DATA \EM31489E.D
. Tue Mar 14 09:38:07 1995 Page 6
i
.Pk#.j RT ArOC% Librcry/ID R;f# Quol
. CAS# )
66 25.37 1.17 C:\ DATABASE \NBS75K.L Pentanamide 1620 000626-97-1 43 2-Hexanol, 2-methyl- 3353 000625-23-0 38 Propane, 2-methoxy- . 332 000$98-53-8 38 67 25.42 0.80 C:\ DATABASE \NBS75K.L Propane, 1-ethoxy-2-methyl- 1772 000627-02-1 43 Pentanamide 1620 000626-97-1 43 Butane, 1-ethoxy- 63548 000628-81-9 43 68 25.49 1.40 C:\ DATABASE \NBS75K.L Heneicosane 72685 000629-94-7 90 Eicosane 72326'000112-95-8 56 l Tricosane 46165 000638-67-5 55 l
l 69 25.75 0.77 C:\ DATABASE \NBS75K.L Acetamide, N-methyl-N- [4 - [4 -me thox 31490 000000-00-0 96 Docosane 44318 000629-97-0 91 1-Docosene 72943 001599-67-3 83 70 25.86 0.33 C:\ DATABASE \NBS75K.L Acetamide , N-methyl-N- [4 - [4 -methox 31490 000000-00-0 89 5 , 9 -Dime thyl (1 - me thyl e thyliden e 28752 069239-72-1 53 10-Heneicosene (c,t) 41868 000000-00-0 50 71 25.96 1.05 C:\ DATABASE \NBS75K.L
- Acetamide, N- [ (4. alpha. ,5. alpha. ) - 55903 013944-35-9 30 2H-1,4-Benzodiazepin-2-one, 7-chlo 55928 05531.0-93-2 15 l
Benzeneacetic acid, . alpha.,3,4-tr 74565 037148-65-5 12 72 26.81 0.28 C:\ DATABASE \NBS75K.L 3,5-Dibutoxy-1,1,1,7,7,7-hexamethy 60473 072439-85-1 9 3,5-Diisopropoxy-1,1,1,7,7,7-hexam 59994 071579-67-4 9 73 26.87 0.40 C:\ DATABASE \NBS75K.L Benzyl butyl phthalate 44507 000085-68-7 95 Benzyl butyl phthalate 73030 000085-68-7 72 Benzene, 1-isothiocyanato-4-methyl 9449 000622-59-3 43 74 27.34 0.50 C:\ DATABASE \NBS75K.L Hexanedioic acid, bis (2-ethylhexyl 73987 000103-23-1 74 Hexanedioic acid, dioctyl ester 51386 000123-79-5 49 Hexanedioic acid, mono (2-ethylhexy 35514 004337-65-9 47 75 27.53 0.35 C:\ DATABASE \NBS75K.L Phosphoric acid, triphenyl ester 73338 000115-86-6 99 Phosphoric acid, triphenyl ester 46311 000115-86-6 S4 Phosphoric acid, triphenyl ester 73337 000115-86-6 93, 76 27.65 0.26 C:\ DATABASE \NBS75K.L 1,1,1,5,7,7,7-Heptamethyl-3,3 -bis ( 56714 038147-00-1 38 Trisiloxane, 1,1,1,5,5,5-hexamethy 52459 003555-47-3 22 Heptasiloxane, hexadecamethyl- 59695 000541-01-5 10 C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:38:52 1995 Page 7
,Pk#..RT Arcn% Librcry/ID . R0f# CAS# Qunl 77 27.75 0.11 C:\ DATABASE \NBS75K.L Pregnan-20-one, (5. alpha.,17. alpha 72829 007704-90-7 50 Pregnan-3-one, (5. alpha . ) - 43210 014778-11-1 38 Chol-23-ene, ( 5. beta . ) - 46698 054411-82-4 38
~
78 27.99 10.77 C:\ DATABASE \NBS75K.L Octicizer 50542 001241-94-7 87 2 - (4 - Cyanophenyl) dime thylaminom 34091 000000-00-0 47 Benz [b] acridine, 1,2,3,4,7,8,9,10- 34157 055044-74-1 37 79 28.12 1.00 C:\ DATABASE \NBS75K.L No matches found 80 28.18 0.24 C:\ DATABASE \NBS75K.L Quinoline, 4 - [2- (4 -methoxyphenyl) e 36082 031059-68-4 46 Androstane, (5. alpha.,14. beta.)- 35961 022511-92-8 25 Androstara, (5. beta.)- 71738 000438-23-3 15 81 28.27 0.12 C:\ DATABASE \NBS75K.L 2-Naphthalenemethanol, 2,3,4,4a,5, 28228 063891-61-2 40 Oxepane, 2,2,3-trimethyl- 1518 023120-43-6 38 2-Butanol, 2,3-dimethyl- 63571 000594-60-5 35 82 28.33 0.14 C:\ DATABASE \NBS75K.L 2-Pentanol, 3-chloro-2-methyl- 6423 074685-49-7 35 Cyclooctanemethanol, . alpha.,.alph 15325 016624-06-9 35 Octanal, 7-hydroxy-3,7-dimethyl- 15806 000107-75-5 35 83 28.39 0.13 C:\ DATABASE \NBS75K.L 2 - Propanol , 1 - [2 - ( 2 -me thoxy- 1-meth 24251 020324-33-8 50 1-Chloro-2-ethoxyethane 2079 000628-34-2 43 2-Butanol, 2,3-dimethyl- 63571 000594-60-5 38 84 28.46 0.51 C:\ DATABASE \NBS75K.L Butanamide, 3-methyl- 1621 000541-46-8 38 2-Propanol, 1-[1-methyl-2-(2-prope 16196 055956-25-7 38 3-Ethyl-2-methyl-2-pentanol 5501 000000-00-0 38 85 28.56 0.24 C:\ DATABASE \NBS75K.L .
Propanoic acid, 2-hydroxy-2-methyl 5790 000080-55-7 50 Pentane, 2-methoxy- 1778 006795-88-6 43 3-Hydroxy-3-methyl-2-butanone 63477 000115-22-0 38 86 28.64 0.54 C:\ DATABASE \NBS75K.L l-Methamphetamine 9504 000000-00-0 43 2-Hexanol, 2-methyl- 64354 000625-23-0 38 2-Hexanol, 2-methyl- 64355 000625-23-0 38 87 28.76 0.25 C:\ DATABASE \NBS75K.L -
l Propane, 1-ethoxy-2-methyl- 63543 000627-02-1 38 l Propane, 1-ethoxy-2-methyl- 63544 000627-02-1 38 l Butane, 2-methoxy- 854 006795-87-5 38 l
88 29.08 0.15 C:\ DATABASE \NBS75K.L l Methylcitric acid, tetrakis (trimet 58778 000000-00-0 9 l l
C:\HPCHEM\1\ DATA \EM31489E.D Tue. Mar 14 09:39:15 1995 Page 8
..Pk#. RT' Arant. Library /ID .- Raf#. CAS#. Quni- ;
..t ;
89 29.41 0.06 C:\ DATABASE \NBS75K.L __ l Phosphine oxide, triphenyl-' '
'72220 000791-28-6 89 -i Phosphine oxide, triphenyl- 39186 000791-28-6 89 !
(Carbethoxyethylidine)triphenylpho. 50583 005717-37-3 68 ;
I
~90j 29.54 0.16 C:\ DATABASE \NBS75K.L i 1,2-Benzenedicarboxylic acid, 3-ni 25513 000603-11-2 68 ,
Bis (2-ethylhexyl) . phthalate 53168'000117-81-7.64- j 1,2-Benzenedicarboxylic acid, decy 55241.000119-07-3 58- l i
91 '29.80 0.25 C:\ DATABASE \NBS75K.L I
! Silane , - [ [4 - [1,2-bis [ (trimethylsil 57393 056114-62-6 27 :l Heptasiloxane, hexadecamethyl- 59695 000541-01-5 22 Benzoic acid, 2,5-bis (trimethylsil 51295.003618-20-0 15' ;
92 31.65 0.79 C:\ DATABASE \NBS75K.L _
Phosphoric acid, tris (3-methylphen 51124 000563-04-2 99 r Phosphoric acid, tris (methylphenyl 73955 001330-78-5'93 !
Phosphoric acid, tris (methylphenyl 51123 001330-78-5 91 l 93 32.05 0.07 C:\ DATABASE \NBS75K.L _
l Phenol, diethyl- 9816 026967-65-7.50 l Benzothiazole 65591 000095-16-9 50 !
Benzothiazole 6263 000095-16-9 50' 94 32.31 0.86 C:\ DATABASE \NBS75K.L. . .
j Phosphoric acid, tris (3-methylphen - 51124 000563-04-2 99 ;
Phosphoric acid, tris (methylphenyl- 73955 001330-78-5'94 j Phosphoric acid, tris (methylphenyl 51123 001330-78-5 94' l 95 32.82 0.19 C:\ DATABASE \NBS75K.L l 1,1,1,5,7,7,7-Heptamethyl-3,3-bis (- 56714 038147-00-1 38 .l Trisiloxane, 1,1,1,5,5,5-hexamethy 52459 003555-47-3122 :
Benzoic acid, 2,4-bis [(trimethylsi 73975 010586-16-0 15 l 96 32.99 0.36 C:\ DATABASE \NBS75K.L I Phosphoric acid, tris (3-methylphen 51124 000563-04-2!98 ;
Phosphoric acid, tris (methylphenyl 73955 001330-78-5 93 1 Phosphoric acid, tris (methylphenyl 51123 001330-78-5 91 l 1
97 34.89 0.09 C:\ DATABASE \NBS75K.L i Silanol, trimethyl , pyrophosphate 57733 018395-45-4 46 Fluorene-2-carbonitrile, 9-(triphe 57099 007293-78-9 27 l ' H - Andros t eno [ 3 , 2 -bl indol o 57100 055401-42-8 12 C:\HPCHEM\1\ DATA \EM31489E.D Tue Mar 14 09:39:29 1995 Page 9
i
,q,d 4,
'e Area Percent Report -- Sorted by Signal-
' ~
Information from Data' File: .
File .: C:\HPCHEM\1\ DATA \EM31489E.D
' Operator : Marti-Acquired : 14 Mar.95 8:57 am using AcqMethod EM31492 Simple Name: 0395-10e Misc Info . :1 Pyrolysis of.thermolag samples
' Vial Number:'1 y
CurrentMeth:-C:\HPCHEM\1\ METHODS \EM31492.M I. Retention Time Area. Area % Ratio % l L
{
Total Ion Chromatogram 1.724 711255783 4.762 .23.972 1.917 124472202 0.833 4.195.
.2.109 58956852 0.395 1.987 2.303 45967364 0.308- 1.549 2.878 '17425144 0.117 0.587 2.990 75976141 0.509 2.561 3.406 21116542 0.141 0.712.
3.479' 44654307 0.299 1.505 g '5.025 124222452 0.832 '4.187 l
6.810 15620990 0.105 0.526 6.952 11298866 0.076 0.381 7.102 84146483 0.563 2.836 7.314 3168995 0.021 0.107.
8.619 18231534 0.122 0.614 8.932 18558897- 0.124 0.626 9.122 50630396 0.339 1.706 9.397 109191335 0.731 3.680 9.952 7280850 0.049 0.245 11.610 44007262 0.295 1.483 16.488 9972645 0.067 0.336 17.561 69768182 0.467 2.351 17.739 58766886 0.393 1.981 18.578 11976985 0.080 0.404 18.968 12268901 0.082- 0.414 19.073 7732646 0.052 0.261 19.136 13717457 0.092 0.462 19.708 103984678 0.696 3.505 19.859 36240792 0.243 1.221 19.980 85204207 0.570 2.872 20.019 63907208 0.428 2.154 20.108 251550437 1.684 8.478 20.454 23669654 0.158 0.798 20.813 420639205 2.816 14.177 21.086 425024798 2.846 14.325 21.450 97336353 0.652 3.281 C:\HPCHEM\1\ DATA \EM31489E.D Wed Mar 22 13:50:46 1995 Page 1
.._ .- . . . . . . . I
t , < ,
(
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Area Percent ReportL-- Sorted 7 by Signal O, >
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'Information from Data File: l
. File : C:\HPCHEM\1\ DATA \EM31489E.D !'
1 Operator : Marti ;
Acquired : 14 Mar 95 8:57 am using AcqMethod EM31492 SCmple Name: 0395-10e Misc l Info. : Pyrolysis of thermolag' samples l
Vial Number:.1' CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M 'f i
Retention Time Area Area % Ratio % l i
21.497- 83879841 0.562 2.827 ;
~21.683 116668269 0.781 3.932 !
22.187 2966985875 19.866 100.00C !
22.252- 458508817 3.070 15.454 l 22.324 1147844428 7.685- 38.687. !
22.476 160219894 1.073 5.400 22.551 178396395 1.194 6.013 !
22.755 257457987 1.724 8.677 ?
22.805 289604000 1.939 9.761 i 22.878 131752226 0.882 4.441 23.025 214497697 1.436 7.229 23.136 152549345 1.021 5.182 :
23.268 142452953 0.954 4.801 !
23.472 80084041 0.536 2.699. '
23.542 44675313 0.299 1.506 23.624 73425029 0.492 2.475 1 23.688 72221026 'O.484 2.434 .{
23.957 88098127 0.590 2.969 ;
24.116 151896682 1.017 5.120 !
24.372 157920566 1.057 5.323 l 24.476 50361009' O.337 1.697 '
24.610 53993318 0.362 1.820 24.681 86414282 0.579 '2.913 1 24.776 80452898 0.539 2.712 24.877 81888827 0.548 2.760 '
24.973 94590812 0.633 3.188 ;
25.078 109171905 0.731 3.680 25.157 142279463 0.953 4.795 l 25.206 174527988 1.169 5.882' ,
25.292 177851161 1.191 5.994 25.371 174947996 1.171 5.896 -
.25.415 118969585 0.797 4.010 '
25.490 208867895 1.398 .7.040' j 25.748 115365987 0.772 3.888 i 25.854 48676920 0.326 1.641 )
25.958 156446561 1.047 5.273 l
i C:\HPCHEM\1\ DATA \EM31489E.D Wed Mar 22 13:50:48 1995 Page 2
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V l, . - .' -
' Area Percent Report -- Sorted by Signal
~Information from Data File:
File : C:\HPCHEM\1\ DATA \EM31489E.D.
l Operator' : Marti~
-Acquired : '14 Mar 95 8:57 am using AcqMethod EM31492 ES mple Name: 0395-10e Misc Info : Pyrolysis of.thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M Retention Time Area Area % Ratio %
26.810 42456309 0.284 1.431 26.865 60073174 0.402 -2.025 27.331 73956434 0.495 2.493
.27.529 52475478 0.351 1.769 27.650 39473928 0.264 1.330 27.758 16154048 0.108' O.544
-27.992 1609213996 10.775 54.237 28.126 149298672 1.000 5.032 28.187 36096398 0.242 1.217 28.270 17567819 -0.118 0.592 28.323 21593217 0.145 0.728 28.382 20134644 0.135 0.679 28.452 76413430 0.512 2.575 28.561 35287650 0.236 1.189 28.640 81390531 0.545 2.743 28~.756 37728967 0.253 1.272 29.077 22555810 0.151 0.760 29.411 8325974 0.056 'O.281 29.538 23229228 0.156 0.783 29.811 37209344 0.249 1.254 31.659 118722220 0.795 4.001
- 32.047 10210847 0.068 0.344 32.313 128843343 0.863 4.343 32m827 27686528 0.185 0.933 32.993 54451243 0.365 1.835 34.889 12908456 0.086 0.435 C:\HPCHEM\1\ DATA \EM31489E.D Wed Mar 22 13:50:51 1995 Page 3
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l Area Percent Report -- Sorted by Signal Information from Data File:
File : C:\HPCHEM\1\ DATA \EM31489E.D Operator : Marti Acquired : 14 Mar 95 8:57 am using AcqMethod EM31492 Sample Name: 0395-10e Misc Info : Pyrolysis of thermolag samples Vial Number: 1 CurrentMeth: C:\HPCHEM\1\ METHODS \EM31492.M Retention Time Area Area % Ratio %
55.00 amu 0.150 454162 3.468 4.571 2.650 1167401 8.915 11.751 2.862 9934705 75.868 100.000 3.410 1069712 8.169 10.767 3.863 171984 1.313 1.731 4.919 222676 1.701 2.241 5.010' 74018 0.565 0.745 69.00 amu 2.137 757847 9.076 10.695 2.352 505717 6.057 7.137 2.990 7086296 84.867 100.000 C:\HPCHEM\1\ DATA \EM31489E.D Wed Mar 22 13:52:21 1995 Page 1