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Octadecanoic acid, 10-methyl-, methyl ester
SpectraBase Compound ID 9YFwTEp9G6E
InChI InChI=1S/C20H40O2/c1-4-5-6-7-10-13-16-19(2)17-14-11-8-9-12-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey ATERKICZYCBQCQ-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJOfzMVCNTE
Name 10-methyloctadecanoate
CAS Registry Number 2490-19-9
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 312.302830526 u
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-5-6-7-10-13-16-19(2)17-14-11-8-9-12-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey ATERKICZYCBQCQ-UHFFFAOYSA-N
Molecular Weight 312.538 g/mol
Number of Peaks 50
RI2 1842
RI4 2165
RI5 1838
SMILES C(CCCCCCCCC(CCCCCCCC)C)(=O)OC
SPLASH splash10-0596-9200000000-238523276070e13e327f
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 Octadecanoic acid, 10-methyl-, methyl ester Me. 10-Me C18:0
Wiley ID LM_LIPIDS2016_181