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(3S,4R)-3-Methyl-4-pivaloyloxy-3-vinylcyclohexan-1-one
SpectraBase Compound ID IFNVGNdnncJ
InChI InChI=1S/C14H22O3/c1-6-14(5)9-10(15)7-8-11(14)17-12(16)13(2,3)4/h6,11H,1,7-9H2,2-5H3/t11-,14-/m1/s1
InChIKey AEGSGVYLZKZXDT-BXUZGUMPSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mgivG76Wos
Name (3S,4R)-3-Methyl-4-pivaloyloxy-3-vinylcyclohexan-1-one
Alternate Name(s) (1R,2S)-2-methyl-4-oxo-2-vinylcyclohexyl pivalate 2,2-Dimethylpropanoic acid[(1R,2S)-2-ethenyl-2-methyl-4-oxocyclohexyl]ester 2,2-Dimethylpropionic acid[(1R,2S)-4-keto-2-methyl-2-vinyl-cyclohexyl]ester [(1R,2S)-2-ethenyl-2-methyl-4-oxidanylidene-cyclohexyl]2,2-dimethylpropanoate [(1R,2S)-2-ethenyl-2-methyl-4-oxocyclohexyl]2,2-dimethylpropanoate [(1R,2S)-2-methyl-4-oxo-2-vinyl-cyclohexyl]2,2-dimethylpropanoate 2,2-Dimethylpropanoic acid [(1R,2S)-2-ethenyl-2-methyl-4-oxocyclohexyl] ester [(1R,2S)-2-ethenyl-2-methyl-4-oxocyclohexyl] 2,2-dimethylpropanoate [(1R,2S)-2-methyl-4-oxo-2-vinyl-cyclohexyl] 2,2-dimethylpropanoate [(1R,2S)-2-ethenyl-2-methyl-4-oxidanylidene-cyclohexyl] 2,2-dimethylpropanoate
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Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-6-14(5)9-10(15)7-8-11(14)17-12(16)13(2,3)4/h6,11H,1,7-9H2,2-5H3/t11-,14-/m1/s1
InChIKey AEGSGVYLZKZXDT-BXUZGUMPSA-N
Molecular Weight 238.327 g/mol
SMILES C(O[C@]1([C@@](CC(CC1)=O)(C=C)C)[H])(C(C)(C)C)=O
SPLASH splash10-0a4i-9100000000-65249590496e8386e898
Source of Spectrum E1-42-1396-16
Wiley ID 1552655