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9,12-Hexadecadienoic acid, methyl ester
SpectraBase Compound ID I3EwmZnV96J
InChI InChI=1S/C17H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h5-6,8-9H,3-4,7,10-16H2,1-2H3/b6-5+,9-8+
InChIKey VYFSOVMGRZVLMP-HHWLVVFRSA-N
Mol Weight 266.42 g/mol
Molecular Formula C17H30O2
Exact Mass 266.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fdsCobPwXa
Name Hexadeca-(9,12)-dienoate
CAS Registry Number 2462-80-8
Classification Fatty esters; Fatty acid methyl esters
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 266.224580204 u
Formula C17H30O2
InChI InChI=1S/C17H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h5-6,8-9H,3-4,7,10-16H2,1-2H3/b6-5+,9-8+
InChIKey VYFSOVMGRZVLMP-HHWLVVFRSA-N
Molecular Weight 266.425 g/mol
Number of Peaks 50
RI2 1657
RI4 1905
SMILES C(CCCCCCC\C=C\C\C=C\CCC)(=O)OC
SPLASH splash10-0159-9100000000-33d29b0615c6f440b689
Sample Comments RI1: measured on Equity-1 (Alkanes) RI2: measured on Supelcowax-10 (FAMEs) RI3: measured on Supelcowax-10 (FAEEs) RI4: measured on SLB-5ms (Alkanes) RI5: measured on SLB-5ms (FAMEs)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 9,12-Hexadecadienoic acid, methyl ester Me. C16:2n4
Wiley ID LM_LIPIDS2016_120