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Octanoic acid, 2-oxo-, ethyl ester
SpectraBase Compound ID 9LJcDMymKdW
InChI InChI=1S/C10H18O3/c1-3-5-6-7-8-9(11)10(12)13-4-2/h3-8H2,1-2H3
InChIKey FQKVLKIRSWZHFS-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8Iw3TFmIGR
Name Octanoic acid, 2-oxo-, ethyl ester
Alternate Name(s) 2-ketocaprylic acid ethyl ester 2-Oxooctanoic acid ethyl ester Ethyl 2-oxidanylideneoctanoate Ethyl 2-oxooctanoate
CAS Registry Number 67873-26-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-3-5-6-7-8-9(11)10(12)13-4-2/h3-8H2,1-2H3
InChIKey FQKVLKIRSWZHFS-UHFFFAOYSA-N
Molecular Weight 186.251 g/mol
SMILES C(C(=O)CCCCCC)(=O)OCC
SPLASH splash10-01ox-9300000000-7974d399e4a74666ca3a
Source of Spectrum J-44-1837-0
Wiley ID 1182737