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Methyl 9-oxooctadecanoate
SpectraBase Compound ID 1goVqpO2Jbm
InChI InChI=1S/C19H36O3/c1-3-4-5-6-7-9-12-15-18(20)16-13-10-8-11-14-17-19(21)22-2/h3-17H2,1-2H3
InChIKey NNUFZSSGONRIJT-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 370rXD88PjD
Name Octadecanoic acid, 9-oxo-, methyl ester
Alternate Name(s) Methyl 9-oxooctadecanoate 9-ketostearic acid methyl ester Methyl 9-oxidanylideneoctadecanoate Methyl 9-oxostearate
CAS Registry Number 1842-70-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-3-4-5-6-7-9-12-15-18(20)16-13-10-8-11-14-17-19(21)22-2/h3-17H2,1-2H3
InChIKey NNUFZSSGONRIJT-UHFFFAOYSA-N
Molecular Weight 312.494 g/mol
SMILES CCCCCCCCCC(=O)CCCCCCCC(=O)OC
SPLASH splash10-01vo-0910000000-e7d4c7702b4b84d47987
Source of Spectrum B3-0-178-0
Wiley ID 1313612