NYC 9/11 Public Portal Document
Library Search Compound Report
Data File C:\MSDCHEM\l\DATA\020417\0409LB.D Vial: 4
Acq On 17 Apr 2002 11:51 am Operator: Nefliu
Sample 04/09 1b Inst Instrumen
Mise Multiplr: 1.00
MS Integration Params: LSCINT.e
Quant Method : C:\MSDCHEM\1\METHODS\041702SCAN.M (Chemstation Integrator)
Title : 508 Modified GC/MS scan
Library : C:\DATABASE\NIST98.L
Peak Number 8 Benzoic acid, 2-(1-oxopropyl)- Concentration Rank 16
R.T. EstConc Area Relative to ISTD R.T.
30.58 0.72 ug/L 734903 Chrysene-dl2 30.88
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 Benzoic acid, 2-(1-oxopropyl)- 178 C10H10O3 002360-45-4 38
2 Benzoic acid, 2-(1-oxopropyl)- 178 C10H10O3 002360-45-4 38
3 1,2-Benzenedicarboxylic acid, bu... 304 C18H24O4 000084-64-0 38
4 1,2-Benzenedicarboxylic acid, di... 362 C22H3404 003648-21-3 33
Abundance Scan 4680 (30.577 min): 0409LB.D (-4675) (-) m/z 149.00 100.00%
149
5000-
57
99
167 265
AM
30.20 30.40 30 60 30 80 31.00
n/z—>
0 I1 111 I'1
0 20 40
36,70183 1111 129......... .
60
I
80 100 120 140 160 180 200
I
220 240 260
m/z 57.10 29.86%
Abundance #66791 Benzoic acid. 2-(1 -oxopropyl)
149
U
5000
30 20 30.40 30.60 30.80 31.00
85 m/z 99.10 22.99%
27 50 . 77 93 105 121
1‘IT it T 1T‘ TTI । r11
0—1 । ।15> • । । T । ..95133 । r । । ■« T । । t । । i
161 178
n/z-> 0 20 40 60 80 100 120 140 160 180 200 220 240 260
Abundance #123454: Benzoic acid, 2-(1-oxopropyl)-
149
30 20 30.40 30.60 30.80 31 00
5000- m/z 54.10 11.76%
65
51
77 93 105 121133
n/z->
4
0- T' • । • । ■ ■ ■ ■ । । • rt | r»
0 20 40 60
< f I t 11 । । । 1‘ । r । । ।
161 178
80 100 120 140 160 180 200 220 240 260
Abundance #66736' 1,2-Benzenedicarboxylic acid, butyl cyclohexyl ester
149
Bpoomotrur 111/4.91
30 20 30.40 30.60 30 80 31 00
m/z 96.10 11.23%
5000
29 41 55 67 ,83
0 -----TT—TITTITTPTT
104 121 135 167 205 223 *1.11)11., III. |(l.
n/z- > 0 20 40 60 80 100 120 140 160 180 200 220 240 260 30.20 30.40 30 60 30.80 31 00
0409LB.D 041702SCAN.M Thu Apr 18 09:42:00 2002 Page 15
NYC-WTC_000048242
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