NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C:\MSDCHEM\1\5973N\02FEB21\01511.D Vial: 2
Acq On : 21 Feb 2002 4:01 pm Operator:
Sample : 508 scan Inst : Instrumen
Mise : February 21, 2002 Multiplr: 1.00
MS Integration Params: LSCINT.P
Quant Method : C:\MSDCHEM\1...\HP022102 .M (RTE Integrator)
Title : 508 scan method
Library : C:\DATABASE\WILEY7N.L
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Peak Number 7 3-Hydroxy-2,2,4-trimethyl-3... Concentration Rank 12
R.T. EstConc Area Relative to ISTD R.T.
16.55 0.02 ug/L 15345 Acenapht hene-d10 18.34
Hit# of 5 Tentative ID MW MolForm CAS# Qual
l 3-Hydroxy-2,2,4-trimethyl-3-pent... 140 C8H12O2 003173-79-3 5
2 4-Isopropylcyclohexanone $$ Cycl... 140 C9H160 005432-85-9 5
3 2H-Pyran-5-carboxylic acid, 2-ox... 140 C6H404 000500-05-0 5
4 3-Methoxy-2-methyl-cyclohex-2-enone 140 C8H12O2 025112-91-8 5
Abundance Scan 1167 (16.548 min): 01511 .D (-) m/z 140.10 100.00%
140
5000
122
84 172
71
16.20 16.40 16.60 16.80
0 1 I“' 'I‘ ‘ ' I • ‘ ‘' I ‘‘ ' I ' 1 ' ‘ I ' ‘ ' I' I | l I n frr.. | . . . , | *‘1** ‘ 1’111111111 TTp m/z 122.00 35.49%
miz-> 20 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170
Abundance #35758:3-Hydroxy-2,2,4-trimethyl-3-pentenoic acid .beta.-...
70
42
5000-
81 140 16.20 16.40 16.60 16.80
m/z 172.20 28.48%
27 96
I -
0- ■ i ■ ■ ■ ■ i ■ ■ ■' i ■i " i' ■•। • i • • > • j»• > • i ■
iz-> :20 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170
Abundance #36265:4-Isopropyicyclohexanone $$ Cyclohexanone, 4-(1-me...
43
69 140
55 84 16.20 16.40 16.60 16.80
5000 m/z 136.10 26.02%
97
107 122
0' ■ i “ “ i ■ “ ■ i11 ‘11 “ ‘11 ‘“ i “ " i ■ 111 ■ “ i
•' • i" •' “ I ' " 1 I 'Till i n ip
niz-> 20 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170
Abundance #35121: 2H-Pyran-5-carboxylic acid, 2-oxo- $$ .alpha.-Pyro... ■ ■ i ' ■ 1 1 i ' ■ ' ' i ■ ■ i ‘ ■ i 1
39 112 16.20 16.40 16.60 16.80
140 m/ Z 84.00 23.53%
5000
J M
v/ ABN L A Ml
66 84
123
m/z—>
O‘i 11 “ 11 “ T H49
* i *' * • F
20 30 40 50 60 70 80 90 100 110 120 130 140 150 160 170
IIBBatITmm 1’1’001—01370 FI ‘ * i * • ‘ 1 1 ‘ *
16.20 16.40 16.60 16.80
01511.D HP022102.M Mon Feb 25 10:55:17 2002 Page 9
NYC-WTC_000010059
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