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Octadecanoic acid, 6-methyl-, methyl ester
SpectraBase Compound ID 6TfaKS6J1mR
InChI InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-11-12-13-16-19(2)17-14-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey OWJLSTXZSGQAQV-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 Hme4wHvzE17
Name Octadecanoic acid, 6-methyl-, methyl ester
CAS Registry Number 2490-21-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-11-12-13-16-19(2)17-14-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey OWJLSTXZSGQAQV-UHFFFAOYSA-N
Molecular Weight 312.538 g/mol
SMILES C(C(CCCCCCCCCCCC)C)CCCC(OC)=O
SPLASH splash10-0079-9230000000-42335b91bc14ac1d3c94
Source of Spectrum EP-4671-0-0
Synonyms Methyl 6-methyloctadecanoate 6-Methyloctadecanoic acid methyl ester 6-Methylstearic acid methyl ester Methyl 6-methyloctadecanoic acid
Wiley ID 1313766