NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C:\MSDCHEM\1\5973N\02FEB05\00028A.D Vial: 4
Acq On 5 Feb 2002 5:27 pm Operator:
Sample : 508 scan; re-ext Inst : Instrumen
Mise : February 5, 2002 Multiplr: 1.00
MS Integration Params: LSCINT.P
Quant Method : C:\MSDCHEM\1...\HP020702.M (RTE Integrator)
Title : 508 scan method
Library : C:\DATABASE\WILEY7N.L
Peak Number 9 Pyrimidinetetramine- $$ Pyr... Concentration Rank 10
R.T. EstConc Area Relative to ISTD R.T.
16.55 0.05 ug/L 59272 Acenaphthene-dl0 18.35
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 Pyrimidinetetramine- $$ Pyrimidi... 140 C4H8N6 001004-74-6 43 B_
2 4 -HYDROXY-BI CYCLO [2.2.2] OCTANONE . . . 140 C8H1202 066348-59-2 43
3 2,5-Cyclohexadiene-1,4-dione, 2,... 140 C6H404 000615-94-1 37
4 Phenol, 4-(methylthio)- (CAS) $$... 140 C7H80S 001073-72-9 25
Abundance Scan 1154 (16.549 min): 00028A.D (-) m/z 140.20 100.00%
140
5000
172
71 122
43 56
— 89 16.20 16.40 16.60 16.80
m/z->
01-
40 50
■ ।1 ■ ■ 11 ■
60 70
—2.4
80 90
98
1111 ■■1111'111
—
1’’1/1-111 i
100 110 120 130 140 150 160 170 180
i
■ ■ 11 ■ m/z 172.20 32.91%
Abundance #35040: Pyrimidinetetramine- $$ Pyrimidine, 2,4,5,6-tetraa...
140
5000 1 ■ i ■ ■ ■ ' i ■
16.20 16.40 16.60 16.80
44 71 123 m/ z 138.10 26.38%
86 96 112
0- ■ ■ i1 " " i " ।11111'h " " J1'111 1 i1 '1 * i i 1 ' ■ ' i '
n/z-> 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180
Abundance #35653: 4-HYDROXY-BICYCLO[2.2.2]OCTANONE $$ Bicyclo[2.2.2]...
83 140
55
70
97
112 16.20 16.40 16.60 16.80
5000 m/z 122.10 25.72%
125
0—PPPPp—T ■' i' '
...Il 1 ■ i'1 ■ ■ i' ‘ -----
m/z-> 40 50 60 70 80 90 100 110 120 130 140 150 160 170 180
Abundance i#35122:2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy- $$ p-...
140 16.20 16.40 16.60 16.80
m/z 71.10 24.15%
5000 42
71
53 84 ,............... ..................................
94 112
m/z->
0 T’1-
40
1 ■ i ■'
50
..60 I,70....80I.90 100 110 120 130 140 150 160 170 180 I.. ■"...... I'
16.20 16.40 16.60 16.80
00028A.D HP020702.M Thu Feb 21 15:48:54 2002 Page 11
NYC-WTC_000004854
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