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METHYL-8-OXO-OCTADECANOATE
SpectraBase Compound ID 7zOU9CYMp06
InChI InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-12-15-18(20)16-13-10-11-14-17-19(21)22-2/h3-17H2,1-2H3
InChIKey WYJRXGALGVIRCQ-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C19H36O3
Exact Mass 312.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3E1vMPcUXg
Name Octadecanoic acid, 8-oxo-, methyl ester
CAS Registry Number 2380-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-12-15-18(20)16-13-10-11-14-17-19(21)22-2/h3-17H2,1-2H3
InChIKey WYJRXGALGVIRCQ-UHFFFAOYSA-N
Molecular Weight 312.494 g/mol
SMILES C(CCCCCCC(CCCCCCCCCC)=O)(=O)OC
SPLASH splash10-05wr-1900000000-498e58c64e79489d495f
Source of Spectrum JX-2015-6-10743
Synonyms Methyl 8-oxooctadecanoate 8-Ketostearic acid methyl ester Methyl 8-oxidanylideneoctadecanoate Methyl 8-oxostearate 8-Oxooctadecanoic acid methyl ester
Wiley ID 1730780