NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C:\MSDCHEM\1\5973N\02JAN22\31664.D Vial: 1
Acq On : 22 Jan 2002 2:41 pm Operator:
Sample : 508 scan Inst : Instrumen
Mise : January 22, 2002 Multiplr: 1.00
MS Integration Params: LSCINT.P
Quant Method : C:\MSDCHEM\1...\SCAN508.M (RTE Integrator)
Title : 508 scan method
Library : C:\DATABASE\WILEY7N.L
*********************************************************************
Peak Number 5 Isopropyl isothiocyanate $$... Concentration Rank 8
R.T. EstConc Area Relative to ISTD R.T.
12.85 0.04 ug/L 15678 Naphthalene-d8 13.19
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 Isopropyl isothiocyanate $$ Prop... 101 C4H7NS 002253-73-8 4
2 Morpholine, 4-methyl- (CAS) $$ N... 101 C5H11N0 000109-02-4 3
3 3H-l,2,4-Triazole-3-thione, 1,2-... 101 C2H3N3S 003179-31-5 2
4 Formamide, N,N-diethyl- 101 C5H11NO 000617-84-5 2
Abundance Scan 830 (12.850 min): 31664.D (-) m/z 43.10 100.00%
43 101
5000
49
84
12.60 12.80 13.00 13.20
111 ■ ■ ■11 11 “' i1 “111 “1 r 11 • ■ “ i • ■ ■ • i •1 “ i ■ • ■ ■ i ■ • • ‘ i • ■ ■ • i ■' ‘ ■ i ■ । • • “ i “
m/z 101.00 89.64%
nz—> 30 35 40 45 50 55 60 65 70 75 80 85 90 95 100 105 110
Abundance #8799: Isopropyl Isothiocyanate $$ Propane, 2-isothiocyanato- A
43
101
5000
60 12.60 12.80 13.00 13.20
86 m/z 41.10 30 97%
54 70
11pt paabaapoapunn■■ i1 ■" i" "i 11 ■ l" • ■ i ■ ■
niz-> 30 35 40 45 50 55 60 65 70 75 80 85 90 95 100 105 110
Abundance #8881: Morpholine, 4-methyl- (CAS) $$ N-methylmorpholine $...
43
’+1411+t
■ ■ i ■ ■ • ■ i
12.60 12.80 13.00 13.20__
5000 14%
101
[■■■■I...... ।
i 56
71
111"111 “ 11111 ■ i ‘1 ■ ■ । ■11'1 “ ।
M
। । । । 1 'l I I J l I I I
n/z-> 30 35 40 45 50 55 60 65 70 75 80 85 90 95 1CO 105 110
Abundance #8735:3H-1,2,4-Triazole-3-thione, 1,2-dihydro-
101 12.60 12.80 13.00 13.20
m/z 40.00 1.47%
5000 42 69
74
HTT 1I1u10000—3i‘r i •1 ■11 “ “ i' •'111'1' i “ " i" ”i ■n-rp-rrrp-r
miz-> 30 35 40 45 50 55 60 65 70 75 80 85 90 95 100 105 110 12.60 12.80 13.00 13.20
31664.D SCAN508.M Thu Jan 24 14:00:06 2002 Page 7
NYC-WTC_000050268
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