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Sebaleate <methyl->
SpectraBase Compound ID LF8gnU1mmbc
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/h11-12,14-15H,3-10,13,16-18H2,1-2H3/b12-11-,15-14-
InChIKey MOJNITLXOYTAOQ-HDXUUTQWSA-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 B3hPUY28HZN
Name Sebaleate
CAS Registry Number 18287-19-9
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/h11-12,14-15H,3-10,13,16-18H2,1-2H3/b12-11-,15-14-
InChIKey MOJNITLXOYTAOQ-HDXUUTQWSA-N
Molecular Weight 294.479 g/mol
Number of Peaks 221
RI2 1854
RI4 2079
RI5 1754
SMILES C(CCC\C=C/C\C=C/CCCCCCCCC)(=O)OC
SPLASH splash10-00lv-9400000000-6c89f0f5745febb679e9
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 5,8-Octadecadienoic acid, methyl ester, (Z,Z)- (8CI,9CI) Me. C18:2 n10
Wiley ID LM_LIPIDS2016_213