NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C:\MSDCHEM\l\DATA\052302\11930.D Vial: 10
Acq On : 23 May 2002 5:18 pm Operator: Mclean
Sample : 5/22ad Inst : Instrumen
Mise Multiplr: 1.00
MS Integration Params: LSCINT.e
Quant Method : C:\MSDCHEM\1\METHODS\052202.M (Chemstation Integrator)
Title : 508 Modified GC/MS scan
Library : C:\DATABASE\NIST98.L
*********************************************************************
Peak Number 8 Acetoacetic acid, 1-thio-, . Concentration Rank 8
R.T. EstConc Area Relative to ISTD R.T.
4.00 0.66 ug/L 388087 1,4-Dichlorobenzene-d4 9.90
Hit# of 5 Tentative ID MW MolForm CAS# Qua
1 Acetoacetic acid, 1-thio-, S-all... 158 C7H10O2S 015780-65-1 2
2 1-Propene, 1-chloro-, (Z)- 76 C3H5C1 016136-84-8/2
3 3-Hexen-l-ol, acetate, (E)- 142 C8H14O2 003681-82-1 2
4 2-Methyl-pyrrol ine 83 C5H9N 1000143-24-0 2
Abundance Scan 156 (3.996 min): 1193O.D(-155)(-) m/z 43.10 10®.00%
5000
43
82 M
3.60 3.80 4.00 4.20 4.40
0! TUT ■i>■•>।> ■ ■ ■ i ■ ‘ “ i ■ • ■ ■ i ■ • ■ ■ i ■' ■ ■ i ■ ■' ■ i " ■ ■ i ■ ■ •' t
m/z 48.10 63.39%
niz-> 10 20 30 40 50 60 70 80 90 100 110 120 130 140 150 160
Abundance
43
#4034: Acetoacetic acid, 1 -thio-, S-allyl ester
./MMMuo.
5000 27 3.60 3.80 4.00 4.20 4.40
69 m/z 41.10 56.75%
59
niz->
01 --pl 125 158
10 20 30 40 50 60 70 80 90 100 110 120 130 140 150 160
■ i • ■ “ I • ■ ■ ■ i ‘ ■ i ■ i ■ “ ■ i ■1 ■ ■ i ■ “ ' i ■1
Abundance #1588:1-Propene, 1 -chloro-, (Z)-
41
• ! i » > * | i * r i [ . . • ) । '
3.60 3.80 4.00 4.20 4.40
5000 m/z 44.00 53.09%
76
miz->
15
01 TIT —ll ■ MI49lp’ ' ■ 61’i ' ■ i
1 I l r i■ ■' ■ i ■ ‘ ■ i ■ ■ ■•i■■■ ■ i “ ■ ■ i ■ ■1' i1■■■i" " i"
10 :20 30 40 50 60 70 80 90 100 110 120 130 140 150 160
Abundance #6004:3-Hexen-1-ol, acetate, (E)-
43 3.60 3.80 4.00 4.20 4.40
67 m/z 81.90 48.51%
U___
82
5000
27
54
n/z—>
O' Immspual lL p1—4 ■ ■11 ■ ■ ■ ‘ i “ " i “ ■ ■ i ■ “ ■ ।
10 20 30 40 50 60 70 80 90 100 110 120 130 140 150 160
“ ।■ i ■ ■ “ ।
L
3.60 3.80 4.00 4.20 4.40
11930.D 052202.M Wed May 29 09:50:19 2002 Page 11
NYC-WTC_000013566
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