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(1S,2R)-1,2-dimethyl-5-oxo-1-cyclopent-3-enecarboxylic acid methyl ester
SpectraBase Compound ID 11zKgpFy2yN
InChI InChI=1S/C9H12O3/c1-6-4-5-7(10)9(6,2)8(11)12-3/h4-6H,1-3H3/t6-,9+/m1/s1
InChIKey VFTJIGARIXPNCH-MUWHJKNJSA-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 IbJOgovUnW2
Name (1S,2R)-1,2-dimethyl-5-oxo-1-cyclopent-3-enecarboxylic acid methyl ester
Alternate Name(s) (1S,5R)-2-keto-1,5-dimethyl-cyclopent-3-ene-1-carboxylic acid methyl ester Methyl (1S,2R)-1,2-dimethyl-5-oxidanylidene-cyclopent-3-ene-1-carboxylate Methyl (1S,2R)-1,2-dimethyl-5-oxo-cyclopent-3-ene-1-carboxylate
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Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6-4-5-7(10)9(6,2)8(11)12-3/h4-6H,1-3H3/t6-,9+/m1/s1
InChIKey VFTJIGARIXPNCH-MUWHJKNJSA-N
Molecular Weight 168.192 g/mol
SMILES [C@]1(C(=O)OC)(C(C=C[C@]1(C)[H])=O)C
SPLASH splash10-0pvu-6900000000-d28a12c6ae7d54abc17b
Source of Spectrum KC-1-2128-7
Wiley ID 825736