NYC 9/11 Public Portal Document
Library Search Compound Report
Data File C:\MSDCHEM\l\DATA\060702\12735.D Vial: 11
Acq On 7 Jun 2002 4:43 pm Operator:
Sample Inst : Instrumen
Mise : Multiplr: 1.00
MS Integration Params: LSCINT.e
Quant Method : C:\MSDCHEM\l\METHQDS\060302.M (Chemstation Integrator)
Title : 508 Modified GC/MS scan
Library : C:\DATABASE\NIST98.L
*********************************************************************
Peak Number 20 Cyclohexane, 1-ethynyl-l-is... Concentration Rank 16
R.T. EstConc Area Relative to ISTD R.T.
34.93 0.40 ug/L 184305 Perylene-dl2 34.65
Hit# of 5 Tentative ID MW MolForm CAS# Qua
1 Cyclohexane, 1-ethynyl-1-isocyano- 133 C9H11N 138313-44-7 6
2 Cyclohexanecarbonitrile, 1-ethynyl- 133 C9H11N 138313-45-8/16
3 7-.Isopropyl-12-methyl-13-methyli . . . 261 C15H19NO3 1000065-51-4 9
4 Quinoline, 1,2,3,4-tetrahydro- 133 C9H11N 000635-46/1 5
Abundance Scan 5421 (34.931 min): 12735.D (-5419) (-) m/z 131.80 100.00%
132 263
118
51
5000 207
—
34.60 34.80 35.00 35.20
84
0- ‘ I ' ‘ ‘ 1 I ‘ 1 ' ■ I ' ' TTH 111:114144 -1PTITII m/z 263.10 86.75%
miz-> 20 40 60 80 100 120 140 160 180 200 220 240 260
Abundance #59605: Cyclohexane, 1-ethynyl-1-isocyano-
132
91 118
104 118
5000 39 51
34*60 34.80 35.00 35.20
27 65 78
m/z 118.10 71.52%|
0 r 4 1 4 I— |
* i ill, ill,J1
miz-> 20 40 60 80 100 120 140 160 180 200 220 240 260
Abundance #59534: Cyclohexanecarbonitrile, 1-ethynyl-
56 132
78 118 . . f . Te 1 r ri > । । । । । ।
41
34.60 34.80 35.00 35.20
5000 91 m/z 264.10 71.52%|
27 105
m/z—>
0-
20
+ll 40 60
, al, all, i'1 — —
80 100 120 140 160 180 200 220 240
1 i 1 ' ■ ■ i ■ ' ■ • i ■ ■ ■ ‘ i ■ ■ ■ ■ i ■ ■ ■ ■ i • ■ ' ■ i ■ ■
260
Abundance #4031:7-lsopropyl-12-methyl-1 3-methylidene-2-aza-6,8-diox...
43 34.60 34.80 35.00 35.20
m/z 261.10 65.23
5000 131
91
65 77 144 161 261
103 119
m/z->
O-1
20 40
1AL
60 80 100 120
’I
140 160
190 218 233
.... I.... I , I 246 . ,
■ ‘ i ■ ■ ■ ■ i • ■ ■ ■ i ■ • ■ ■ i ■ 1 ■ • i ' 1
180 200 220 240 260 34.60 34.80 35.00 35.20
12735.D 060302.M Mon Jun 10 11:22:58 2002 Page 23
NYC-WTC_000015198
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