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Ethyl 3-(2-oxo-5-methylcyclohexyl)propionate
SpectraBase Compound ID L1z2qabW94R
InChI InChI=1S/C12H20O3/c1-3-15-12(14)7-5-10-8-9(2)4-6-11(10)13/h9-10H,3-8H2,1-2H3
InChIKey VRMJROHYJWDDNL-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDV0UjD2fxD
Name Ethyl 3-(2-oxo-5-methylcyclohexyl)propionate
Alternate Name(s) Ethyl-(+)-3-(2-oxo-5-methylcyclohexyl)propionate cis-Ethyl (1S,5S)-(+)-3-(2-oxo-5-methylcyclohexyl)propionate Ethyl 3-(5-methyl-2-oxocyclohexyl)propanoate Ethyl trans-3-(2-oxo-5-methylcyclohexyl)propionate
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Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-3-15-12(14)7-5-10-8-9(2)4-6-11(10)13/h9-10H,3-8H2,1-2H3
InChIKey VRMJROHYJWDDNL-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES C1(C(CC(CC1)C)CCC(=O)OCC)=O
SPLASH splash10-066r-9600000000-1dd49cb4fcfe0e1535cc
Source of Spectrum QC-11-2609-2
Wiley ID 859948