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(E)-4-keto-5-methyl-hex-2-enoic acid methyl ester
SpectraBase Compound ID 45OdZfOtzzs
InChI InChI=1S/C8H12O3/c1-6(2)7(9)4-5-8(10)11-3/h4-6H,1-3H3/b5-4+
InChIKey MXGDZSJYAGQXTM-SNAWJCMRSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwkHvELLNru
Name (E)-4-keto-5-methyl-hex-2-enoic acid methyl ester
Alternate Name(s) (E)-5-methyl-4-oxo-2-hexenoic acid methyl ester Methyl (E)-5-methyl-4-oxidanylidene-hex-2-enoate Methyl (E)-5-methyl-4-oxo-hex-2-enoate
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Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-6(2)7(9)4-5-8(10)11-3/h4-6H,1-3H3/b5-4+
InChIKey MXGDZSJYAGQXTM-SNAWJCMRSA-N
Molecular Weight 156.181 g/mol
SMILES C(\C=C\C(=O)C(C)C)(=O)OC
SPLASH splash10-03di-9800000000-9d32f88ea7f7a21e85f0
Source of Spectrum J-59-3208-19
Wiley ID 1153471