NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C:\MSDCHEM\1\DATA\052302\12161.D Vial: 14
Acq On : 23 May 2002 8:33 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 10 Thiocyanic acid, 2-benzothi... Concentration Rank 11
R.T. EstConc Area Relative to ISTD R.T.
22.54 0.25 ug/L 207181 Phenanthranene-dl0 22.91
Hit# of 5 Tentative ID MW MolForm CAS# Qua
1 Thiocyanic acid, 2-benzothiazoly. .. 192 C8H4N2S2 006011-99-0 42
2 2-Propenal, 3-(3,4-dimethoxyphen... 192 C11H1203 004497-40-9 39
3 1,5-Naphthalenedithiole 192 C10H8S2 1000223-69-5 39
4 cis-2-Methyl-4-phenylthiane 192 C12H16S 076097-69-3/9
Abundance Scan 3312 (22.539 min): 12161 .D (-3301) (-) m/z 192.10 100/00%
192
5000
.....
96
40 64 82 146 160 22.20 22.40 22.60 22.80
p
0 1—9——mTRHTT 111 “1 'I' “ • i “ “ i “ ‘ ■ i “'' l * “ ■ I ■ • “ i ■ “ ■ i'" ‘ r m/z 191.10 20.15%
m/z-> 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180 190 200
Abundance #80870: Thiocyanic acid, 2-benzothiazolyl ester
192
5000
22.20 22.40 22.60 22.80
69 m/z 96.10 16.28%
.............. ............ 82 90 108 122 134 148 160
0- . ■ ] > > ■ ■ I > 11 > > > > ] 1-11> > •' ■ i ■ ■
niz-> 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180 190 200
Abundance #80953: 2-Propenal, 3-(3,4-dimethoxyphenyl)- A
192
161
22.20 22.40 22.60 22.80
5000 m/z 146.10 15.27%
77 91 121 149 177
52 64 138
m/z->
0- ..i T..........
’’ npm fri ii...... ,,.. nII....
4111111
i 11 i'l
I .
. n-rf al,. ..I,...
30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180 190 200
‘ I “ '’ I
Utt
Abundance #80950:1,5-Naphthalenedithiole
192 2220 2240 22.60 2280/77
m/z 193.00 12.40%
50001
115 128159
40 57 69 79 96 „ 147
0 —— * I *177
1 *■*!'" "I"
n/z-> 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180 190 200 22.20 22.40 22.60 22.80
12161.D 052202.M Wed May 29 09:54:44 2002 Page 12
NYC-WTC_000013640
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