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METHYL-15-OXO-OCTADECANOATE
SpectraBase Compound ID Apdm1zFDs8P
InChI InChI=1S/C19H36O3/c1-3-15-18(20)16-13-11-9-7-5-4-6-8-10-12-14-17-19(21)22-2/h3-17H2,1-2H3
InChIKey WGCRNNZFROMDJH-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 6uhVPFWxDHd
Name Octadecanoic acid, 15-oxo-, methyl ester
Alternate Name(s) Methyl 15-oxooctadecanoate 15-ketostearic acid methyl ester Methyl 15-oxidanylideneoctadecanoate 15-oxooctadecanoic acid methyl ester
CAS Registry Number 2380-30-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-3-15-18(20)16-13-11-9-7-5-4-6-8-10-12-14-17-19(21)22-2/h3-17H2,1-2H3
InChIKey WGCRNNZFROMDJH-UHFFFAOYSA-N
Molecular Weight 312.494 g/mol
SMILES C(CCCCCCCCCCCCCC(CCC)=O)(=O)OC
SPLASH splash10-0006-9010000000-eb83f8447bf3f60f5afa
Source of Spectrum JX-2015-6-1724
Wiley ID 1728114