NYC 9/11 Public Portal Document
Library Search Compound Report
Data File C:\MSDCHEM\1\DATA\050802\10304 .D Vial: 7
Acq On 8 May 2002 6:41 pm Operator: Mclean
Sample 5/1 eh Inst Instrumen
Mise Multiplr: 1.00
MS Integration Params: LSCINT.e
Quant Method : C:\MSDCHEM\1\METHODS\050102.M (Chernstation Integrator)
Title : 508 Modified GC/MS scan
Library : C:\DATABASE\NIST98.L
*********************************************************************
Peak Number 6 1,3,5-Triazine-2,4,6(1H,3H,... Concentration Rank 8
R.T. EstConc Area Relative to ISTD R.T.
5.06 0.30 ug/L 202916 1,4-Dichlorobenzene-d4 9.93
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 1,3,5-Triazine-2,4,6(1H,3H,5H)-t... 129 C3H3N303 000108-80-5 5
2 2-Chloro-4-aminopyrimidine 129 C4H4C1N3 007461-50-9 5
3 Imidazole, 4-fluoro-5-aminocarbo... 129 C4H4FN3O 033300-35-5 4
4 1,3,5-Triazine-2,4,6(1H,3H,5H)-t... 129 C3H3N303 000108-80-5 4
Abundance Scan 338 (5.065 min): 10304.D (-335) (-) m/z 128.90 100.00%|
129
5000
47
79 91
m/z->
0........ .
20 30
44
40 50
58
1 1 I 1 1 1 1 I 1 1 1 ‘ i ' ■■■i1‘11i ■ 1 ' 1 i 1 ‘ 1 ' 1 1 1 11 I 1111।1 1 1 1 । 1 *
60 70 80 90 100 110 120 130 140 150
4.80
m/z 130.90
5.00 5.20 5.40
40.85%
Abundance #121801:1,3,5-Triazine-2,4,6(1 H,3H,5H)-trione
129
44
5000 171’1’’’11111+++II1
4.80 5.00 5.20 5.40
86 m/z 47.00 34.64%
70
miz->
Abundance
0- ■ > ।
20
29
‘ ■ i11 ■ • * । ।' l
30 40
— 54,.
50 60 70 80 90 100 110 120 130 140 150
#58331:2-Chloro-4-aminopyrimidine
"MMMMMywMMM
119
94 4.80 5.00 5.20 5.40
5000 m/ z 43.10 33.21%
28
35,iI1
O—T '|, i"i
41
i
+ll—1.59+4—
52
1+ ils TT 111 0
77 86
67
116
102
MwMhws/
m/z-> 20 30 40 50 60 70 80 90 100 110 I 120 130 140 150
Abundance #58386: Imidazole, 4-fluoro-5-aminocarbonyl-
1 ‘ 1 ' 1 1 1 1 1 I 1 1 1 1 1 1 1 '' 1 1 1 1 1
129 4.80 5.00 5.20 5.40
m/z 49.90 33.04%
5000 113
44 58 85
I 51 ,h 67 74 i 100 |
0 ' ' I ' ' ' ' I ' ' ' ' I'1'1'1 1 I I'1 ’I । | ■ । । ' l I' । ' । I I | I 1'1 I | I I I । | ! I 1-1 |’l I ! | I I
। 145
'I 1 ''1 i1 1 I T
m/z—> 20 30 40 50 60 70 80 90 100 110 120 130 140 150 4.80 5.00 5.20 5.40
10304.D 050102.M Thu May 09 13:50:23 2002 Page 9
NYC-WTC_000045105
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