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Methyl 2-methyl-6-oxocyclohex-1-enecarboxylate
SpectraBase Compound ID InVtBUrX4eC
InChI InChI=1S/C9H12O3/c1-6-4-3-5-7(10)8(6)9(11)12-2/h3-5H2,1-2H3
InChIKey HOMNCSGKPKMVGP-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGzp5WPqKP7
Name Methyl 2-methyl-6-oxocyclohex-1-enecarboxylate
Alternate Name(s) 2-Methyl-6-oxo-1-cyclohexenecarboxylic acid methyl ester Methyl 2-methyl-6-oxocyclohexene-1-carboxylate Methyl 2-methyl-6-oxo-cyclohexene-1-carboxylate Methyl 2-methyl-6-oxidanylidene-cyclohexene-1-carboxylate
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Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6-4-3-5-7(10)8(6)9(11)12-2/h3-5H2,1-2H3
InChIKey HOMNCSGKPKMVGP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol7023289
Molecular Weight 168.192 g/mol
SMILES C1(CCCC(=C1C(OC)=O)C)=O
SPLASH splash10-01q0-3900000000-a8be55562b4171d6be94
Source of Spectrum A1-9-5111/SMS9-4p
Wiley ID 1758829