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Butanoic acid, 2,2-dimethyl-3-oxo-, ethyl ester
SpectraBase Compound ID HV62ncJ2Hmj
InChI InChI=1S/C8H14O3/c1-5-11-7(10)8(3,4)6(2)9/h5H2,1-4H3
InChIKey NVAHZHOCRQCUBY-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvzT0recx5X
Name Butanoic acid, 2,2-dimethyl-3-oxo-, ethyl ester
CAS Registry Number 597-04-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-5-11-7(10)8(3,4)6(2)9/h5H2,1-4H3
InChIKey NVAHZHOCRQCUBY-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES C(C(=O)OCC)(C(=O)C)(C)C
SPLASH splash10-00rf-9200000000-d99dd3e7d13a13dd1373
Source of Spectrum J-56-5305-3f
Synonyms Ethyl 2,2-dimethyl-3-oxobutanoate 2,2-Dimethyl-3-oxo-butyric acid ethyl ester 2,2-Dimethyl-3-oxobutanoic acid ethyl ester 3-keto-2,2-dimethyl-butyric acid ethyl ester Ethyl 2,2-dimethyl-3-oxidanylidene-butanoate Ethyl 2,2-dimethylacetoacetate AI3-11095 EINECS 209-892-8
Wiley ID 1153452