NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C:\MSDCHEM\l\DATA\032602\4514.D Vial: 59
- Acq On : 27 Mar 2002 9:40 pm Operator: McLean
Sample : SAMPLE 4514 3/2/02 Inst Instrumen
Mise : Multiplr: 1.00
MS Integration Params: LSCINT.P
Quant Method : C:\MSDCHEM\l\5973N\5080302.M (RTE Integrator)
Title : Quantitation For Method 508gcscan
Library : C:\DATABASE\WILEY7N.L
*********************************************************************
Peak Number 1 Acetic acid, 3-[1,3]dioxola... Concentration Rank 1
R.T. EstConc Area Relative to ISTD R.T.
5.58 0.54 ug/L 142051 1,4-Dichlorobenzene-d4 9.55
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 Acetic acid, 3-[1,3]dioxolan-2-y... 174 C8H14O4 000000-00-0 50
2 3-(CYCLOHEX-3'-EN-YL)PROPANOL 174 C8H14O4 015745-87-6 50
3 1,3-Dioxolane 74 C3H6O2 000646-06-0 9
4 1,3-Dioxolane (CAS) $$ 1,3-Dioxo... 74 C3H602 000646-06-0 9
Abundance Scan 425 (5.576 min): 4514.D (-) m/ z 73.20 100.00%
73
5000
43
■ । • ■ ■ ■ । ■ TTTTPMI’r
5.20 5.40 5.60 5.80 6.00
1 55 i 103
............. — 87 m/z 43.20 36.89%
0 H..... mm
m/z->___ 20 30 40 50 60 70 80 90 100110120130140150160170180
r "' r ■
Abundance #78238: Acetic acid, 3-[1,3]dioxolan-2-ylpropyl ester
73
5000
W
X 4 A AM A 4AAA [ I ! I t | I I I I | I
5.20 5.40 5.60 5.80 6.00
m/z 41.10 15.80%
43
27 55 ,l 87 113 131 174
m/z->
0 -- Ir ' ■ TT Hm
" ।1 TTTTmtrT
20 30 40 50 60 70 80 90 100110120130140150160170180
Abundance#36138: 3-(CYCLOHEX-3‘-EN-YL)PROPANOL $$ 2-Cyclohexene-1-p...
70
4 4..
5.20 5.40 5.60 5.80 6.00
m/z 45.10 14.70%
5000
43
27 87
0 T 55 r " ‘IT' ■i''1■i'■'' i ■'' 'i113 131 174
'''' i ■'''i'’''i'''' i'''' i'' ■' i •'''i''
m/z—> 20 30 40 50 60 70 80 90 100110120130140150160170180
Abundance #1996: 1,3-Dioxolane
70 5.20 5.40 5.60 5.80 6.00
m/z 71.10 8.67%
5000 44
29
m/z->
0 mH Th
57
|‘ " 1 | ’ 1] I’T
20 30 40 50 60 70 80 90 100110120130140150160170180
i•■■‘i I' I ■ । ■ i ■ •
L..
5.20 5.40 5.60 5.80 6.00
4514.D 5080302.M Thu Mar 28 06:24:41 2002 Page 3
NYC-WTC_000038710
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