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(9Z)-octadecen-12-ynoate <methyl->
SpectraBase Compound ID K8lJYgKpTJg
InChI InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-6,9,12-18H2,1-2H3/b11-10-
InChIKey PBUBQZYMYOKABE-KHPPLWFESA-N
Mol Weight 292.5 g/mol
Molecular Formula C19H32O2
Exact Mass 292.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATv1P2Qd3XV
Name (9Z)-octadecen-12-ynoate
CAS Registry Number 2907-83-7
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O2
InChI InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-6,9,12-18H2,1-2H3/b11-10-
InChIKey PBUBQZYMYOKABE-KHPPLWFESA-N
Number of Peaks 214
RI2 2039
RI4 2146
RI5 1819
SMILES C(CCCCCCC\C=C/CC#CCCCCC)(=O)OC
SPLASH splash10-0536-9400000000-c97391cccc2510934350
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 9-Octadecen-12-ynoic acid, methyl ester, (9Z)-
Wiley ID LM_LIPIDS2016_209