NYC 9/11 Public Portal Document
Library Search Compound Report
Data File : C: \MSDCHEM\1\5973N\02FEB21\01547.D Vial: 3
Acq On : 21 Feb 2002 4:52 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
*********************************************************************
Peak Number 4 1,3,5-Cycloheptatriene Concentration Rank 7
R.T. EstConc Area Relative to ISTD R.T.
4.38 0.05 ug/L 19011 1,4-Dichlorobenzene-d4 9.72
Hit# of 5 Tentative ID MW MolForm CAS# Qual
1 1,3,5-Cycloheptatriene 92 C7H8 000544-25-2 7
2 1,3,5-Cycloheptatriene $$ Cycloh... 92 C7H8 000544-25-2 7
3 1,6-Heptadien-3-yne 92 C7H8 005150-80-1 5
4 1,6-Heptadien-3-yne 92 C7H8 005150-80-1 5
Abundance Scan 89 (4.379 min): 01547.D (-) m/z 91.00 100.00%
91
5000
44 51 i......
4.00
anoeponosp)
4.20 4.40 4.60 4.80
84
0! ■' i “ ■ • l" ■ ■ i ■ ■ ■ • i “ ■ ■ i ■ • TTHI • । ■ • • > ।• i ■ ■ > • i • • • • i ■ ■ ■' i • ■ ■' i1 ■ • ■ i ’ ■11 ■ ■' ■ i'1 m/z 92.10 52.46%
miz-> 20 25 30 35 40 45 50 55 60 65 70 75 80 85 93 95 100
Abundance #5571:1,3,5-Cycloheptatriene
91
5000
4.00 4.20 4.40 4.60 4.80
65 m/z 44.10 16.64%
27
01 " ।।■11 * i ■ —38,—46..7lsa., • ■ i “ ■ ‘ i ■ ■ ■ ■ i ■ ■ “ i ■ ■1' I 1110011111
d W
miz-> 20 25 30 35 40 45 50 55 60 65 70 75 80 85 90 95 100
Abundance #5570:1,3,5-Cycloheptatriene $$ Cyclohepta-1,3,5-triene $...
91
4.00 4.20 4.40 4.60 4.80
5000 m/z 51.00 15.57%
27 38 46—
51 61,| —mmmmmmp ■ ■ ।
65 A A /I
01 —PTTT -mm । ■1
n/z-> 20 25 30 35 40 45 50 55 60 65 70 75 80 85 90 95 100
Abundance #5556: 1,6-Heptadien-3-yne Iir ■i ■ 1 1 ■ i r ITt T
91 4.00 4.20 4.40 4.60 4.80
m/z 83.90 3.43%
5000
65
WMWwAWMurooan
27 37 51 61. 86 ,
0’ ■ ■ । । ■1 ■ ■ । ■ - “ i “ ■1111 ■ i ■ ■ 1 ■ i 1 ■ 1 ■ i ■ ■ ■ ■ i ' ■ 1 ■ i •
n/z-> 20 25 30 35 40 45 50 55 60 65 70 75 80 85 90 95 100 4.00 4.20 4.40 4.60 4.80
01547.D HP022102.M Mon Feb 25 10:55:24 2002 Page 6
NYC-WTC_000010075
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