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Octadec-(13Z)-enyl acetate
SpectraBase Compound ID 9z4mniNUx6W
InChI InChI=1S/C20H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h6-7H,3-5,8-19H2,1-2H3/b7-6-
InChIKey PPNRRQMJESAXGJ-SREVYHEPSA-N
Mol Weight 310.5 g/mol
Molecular Formula C20H38O2
Exact Mass 310.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AJy9tbtSsH
Name Octadec-(13Z)-enyl acetate
Source of Sample Bedoukian Pheromones; www.bedoukian.com
CAS Registry Number 60037-58-3
Classification Pheromones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 310.287180462 u
Formula C20H38O2
InChI InChI=1S/C20H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h6-7H,3-5,8-19H2,1-2H3/b7-6-
InChIKey PPNRRQMJESAXGJ-SREVYHEPSA-N
Molecular Weight 310.522 g/mol
Number of Peaks 186
RI1 2197
SMILES C(CCCCCCCCCCC\C=C/CCCC)OC(C)=O
SPLASH splash10-05o4-9100000000-72259bb5ed0452d15564
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 13-Octadecen-1-ol, acetate, (13Z)-
Wiley ID LM_PEST_1273