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4-Methyl-2-oxo-6-phenyl-cyclohex-3-enecarboxylic acid ethyl ester
SpectraBase Compound ID HDA5idz39oH
InChI InChI=1S/C16H18O3/c1-3-19-16(18)15-13(9-11(2)10-14(15)17)12-7-5-4-6-8-12/h4-8,10,13,15H,3,9H2,1-2H3
InChIKey PHSJXXBXPDTQJW-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9Sjn302Zro
Name 4-Methyl-2-oxo-6-phenyl-cyclohex-3-enecarboxylic acid ethyl ester
Alternate Name(s) 4-Methyl-2-oxo-6-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester Ethyl 4-methyl-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate Ethyl 4-methyl-2-oxo-6-phenyl-cyclohex-3-ene-1-carboxylate Ethyl 4-methyl-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate
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Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-3-19-16(18)15-13(9-11(2)10-14(15)17)12-7-5-4-6-8-12/h4-8,10,13,15H,3,9H2,1-2H3
InChIKey PHSJXXBXPDTQJW-UHFFFAOYSA-N
Molecular Weight 258.317 g/mol
SMILES C1(C(C=C(CC1c1ccccc1)C)=O)C(=O)OCC
SPLASH splash10-0007-8960000000-de4a90fc02f66e731944
Source of Spectrum F2-44-4791-10
Wiley ID 1705882