NYC 9/11 Public Portal Document
Library Search Compound Report
Data File C:\MSDCHEM\1\DATA\050602\9972.D Vial: 20
Acq On 7 May 2002 3:11 am Operator: Mclean
Sample 4/25 Inst Instrumen
Mise Multiplr: 1.00
MS Integration Params: LSCINT.e
Quant Method : C:\MSDCHEM\1\METHODS\050102.M (Chemstation Integrator)
Title : 508 Modified GC/MS scan
Library : C:\DATABASE\NIST98.L
*********************************************************************
Peak Number 7 Chloroacetic acid, hexyl ester Concentration Rank 3
R.T. EstConc Area Relative to ISTD R.T.
5.10 0.43 ug/L 351021 1,4-Dichlorobenzene-d4 9.94
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 Chloroacetic acid, hexyl ester 178 C8H15C1O2 1000131-85-3
2 Chloroacetic acid, 2-methylpropy... 150 C6H11C1O2 1000131-85-2 27
3 Ethanedioic acid, bis(1-methylpr... 202 C10H18O4 013784-89- 23
4 Butyl aldoxime, 2-methyl-, anti- 101 C5H11NO 049805- ,5-2 10
Abundance Scan 343 (5.094 min): 9972.D (-338) (-) m/ z 44.10 100.00%
44 fl
56
5000
35 72
86
129
T । । । । I । ! । । i । । i । i i । । j i r-i , । , i i । i r
Mrp—n"wA
’111111 1111 * 1111*
4.80 5.00
W 5.20 5.40
...
1 1 11 1 1 11 Th)l ' i ■ ■ ■ ■ । > I 11 m/z 41.10 87.86%
m/z-> 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180
Abundance 1#15104: Chloroacetic acid, hexyl ester
43 56
MM"w " —
5000 “1 0 I l l I "u I I
69 77 4.80 5.00 5.20 5.40
m/ z 56.10 82.05%
85 95
107 121 135 149 163 178
■ ■ । ■ 11 +14 TTT I । । ' I r i । । i ; i j i > i i । । । । । । । । i । । '! i i । i i i i | i i । । । । ' । i । i ।
/z-> 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180
Abundance #15033: Chloroacetic acid, 2-methylpropyl ester
56
41
77 1 1 1 i 1 1 1 1 1 1 1
4.80 5.00 !5.20 5.40
5000 m/z 57.10) 72.32%
108
1111 ‘ ‘11
mill 4— 69, ,, 85 TPTPT
95
I I | I I I rj । i r
123 135
I 1 ' 1 ■ । ■ ■ ■ ■! ■ ■ ■. ।
150
। । । I 1 1 ' 1 (
/z->_____ 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180
Abundance I I I | , ■ 1 I | I T I 1 | I I | I | L | |
#15933: Ethanedioic acid, bis(1 -methylpropyl) ester
57 4.80 5.00 5.20 5.40
41 m/z 128.90 66.60%
5000
। 49
65 73 84 103 117 1 31 147
1111111 rW | । । । । |' i I r ) [ «‘ r I I । । । । । ।' I i i i | 1 i i' i | । । । । । ’ i i i k | '1 I I ‘r | I I I ! | I I I I | I I I I | | I
1 I ' 1 1 1 1 1 1 1 1 I 1 1 1 1 I ' 1
m/z-> 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180 4.80 5.00 5.20 5.40
9972 .D 050102.M Tue May 07 15:50:58 2002 Page 11
NYC-WTC_000044016
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