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11,14-Octadecadienoic acid, methyl ester
SpectraBase Compound ID IlZjQORntwf
InChI InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h5-6,8-9H,3-4,7,10-18H2,1-2H3/b6-5+,9-8+
InChIKey KXQNNBUXFKDSAX-HHWLVVFRSA-N
Mol Weight 294.5 g/mol
Molecular Formula C19H34O2
Exact Mass 294.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdLnWigPZMO
Name Octadeca-(11,14)-dienoate
CAS Registry Number 56554-61-1
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 294.255880333 u
Formula C19H34O2
InChI InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h5-6,8-9H,3-4,7,10-18H2,1-2H3/b6-5+,9-8+
InChIKey KXQNNBUXFKDSAX-HHWLVVFRSA-N
Molecular Weight 294.479 g/mol
Number of Peaks 50
RI2 1869
RI4 2091
SMILES C(CCCCCCCCC\C=C\C\C=C\CCC)(=O)OC
SPLASH splash10-015a-9100000000-3382f6b2c4fe710a1f64
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 11,14-Octadecadienoic acid, methyl ester Me. C18:2n4
Wiley ID LM_LIPIDS2016_128