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cis-7,10,13-NONADECATRIENOIC ACID, METHYL ESTER
SpectraBase Compound ID GJK7q0NG7X2
InChI InChI=1S/C20H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-2/h7-8,10-11,13-14H,3-6,9,12,15-19H2,1-2H3/b8-7-,11-10-,14-13-
InChIKey PWMACEFYSFNGLB-JPFHKJGASA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0pR0mV6YeE
Name 7(Z),10(Z),13(Z)-nonadecatrienoate
CAS Registry Number 13487-45-1
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 306.255880333 u
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-2/h7-8,10-11,13-14H,3-6,9,12,15-19H2,1-2H3/b8-7-,11-10-,14-13-
InChIKey PWMACEFYSFNGLB-JPFHKJGASA-N
Molecular Weight 306.490 g/mol
Number of Peaks 232
RI2 1992
RI4 2172
RI5 1847
SMILES C(CCCCC\C=C/C\C=C/C\C=C/CCCCC)(=O)OC
SPLASH splash10-00nf-9300000000-c2c56e05fe79f26d119f
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 7,10,13-Nonadecatrienoic acid, methyl ester, (7Z,10Z,13Z)- Me. C19:3n6
Wiley ID LM_LIPIDS2016_166