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Butanoic acid, 2-oxo-, methyl ester
SpectraBase Compound ID 4Ss9uaBBMR9
InChI InChI=1S/C5H8O3/c1-3-4(6)5(7)8-2/h3H2,1-2H3
InChIKey XPIWVCAMONZQCP-UHFFFAOYSA-N
Mol Weight 116.12 g/mol
Molecular Formula C5H8O3
Exact Mass 116.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HBaniBHelM
Name Butanoic acid, 2-oxo-, methyl ester
CAS Registry Number 3952-66-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O3
InChI InChI=1S/C5H8O3/c1-3-4(6)5(7)8-2/h3H2,1-2H3
InChIKey XPIWVCAMONZQCP-UHFFFAOYSA-N
Molecular Weight 116.116 g/mol
SMILES C(C(CC)=O)(OC)=O
SPLASH splash10-0a6r-9000000000-8cc7bdc910a107ea14ad
Source of Spectrum EP-1059-0-0
Synonyms Methyl 2-oxobutanoate 2-ketobutyric acid methyl ester 2-Oxobutanoic acid methyl ester Butyric acid, 2-oxo-, methyl ester Methyl .alpha.-oxobutyrate Methyl 2-oxidanylidenebutanoate Methyl 2-oxobutyrate Methyl ester of 2-oxobutanoic acid
Wiley ID 1125325