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Hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester
SpectraBase Compound ID K0tGhI64lH4
InChI InChI=1S/C10H16O4/c1-5-14-9(13)7(11)6-8(12)10(2,3)4/h5-6H2,1-4H3
InChIKey NIMKIMUBJFWPTD-UHFFFAOYSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPd6aX4lkTN
Name Hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester
Alternate Name(s) 2,4-Diketo-5,5-dimethyl-hexanoic acid ethyl ester 5,5-Dimethyl-2,4-dioxohexanoic acid ethyl ester Ethyl 5,5-dimethyl-2,4-bis(oxidanylidene)hexanoate Ethyl 5,5-dimethyl-2,4-dioxo-hexanoate EINECS 236-478-4
CAS Registry Number 13395-36-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-5-14-9(13)7(11)6-8(12)10(2,3)4/h5-6H2,1-4H3
InChIKey NIMKIMUBJFWPTD-UHFFFAOYSA-N
Molecular Weight 200.234 g/mol
SMILES C(CC(C(C)(C)C)=O)(C(=O)OCC)=O
SPLASH splash10-00ou-9600000000-d2e822e3ecd5b5431494
Source of Spectrum J-56-5305-1
Wiley ID 1197482