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(S)-Ethyl 2-(2'-ethenyl-2'-methyl-6'-oxocyclohexyl)ethanoate
SpectraBase Compound ID Ii36kYiADi4
InChI InChI=1S/C13H20O3/c1-4-13(3)8-6-7-11(14)10(13)9-12(15)16-5-2/h4,10H,1,5-9H2,2-3H3/t10-,13?/m1/s1
InChIKey XBDQVCQYPUXRPI-VUUHIHSGSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3U35cz35LU
Name (S)-Ethyl 2-(2'-ethenyl-2'-methyl-6'-oxocyclohexyl)ethanoate
Alternate Name(s) Ethyl 2-(2'-ethenyl-2'-methyl-6'-oxocyclohexyl)ethanoate Ethyl[(1S)-2-methyl-6-oxo-2-vinylcyclohexyl]acetate
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Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-4-13(3)8-6-7-11(14)10(13)9-12(15)16-5-2/h4,10H,1,5-9H2,2-3H3/t10-,13?/m1/s1
InChIKey XBDQVCQYPUXRPI-VUUHIHSGSA-N
Molecular Weight 224.300 g/mol
SMILES [C@]1(C(C=C)(CCCC1=O)C)(CC(=O)OCC)[H]
SPLASH splash10-0059-9600000000-aa8e665a6a7b2b616c68
Source of Spectrum U1-1999-676-3
Wiley ID 752638