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(1S,2S)-2-[2-(2-oxopropyl)cyclohex-1-yl]acrolein
SpectraBase Compound ID 2ZAh2BmeSze
InChI InChI=1S/C12H18O2/c1-9(8-13)12-6-4-3-5-11(12)7-10(2)14/h8,11-12H,1,3-7H2,2H3/t11-,12+/m0/s1
InChIKey GKFBUYKMVFJCMR-NWDGAFQWSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXGalAxOBkd
Name (1S,2S)-2-[2-(2-oxopropyl)cyclohex-1-yl]acrolein
Alternate Name(s) 2-[(1S,2S)-2-(2-oxopropyl)cyclohexyl]acrylaldehyde 2-[cis-2-(2-oxopropyl)cyclohex-1-yl]acrolein 2-[(1S,2S)-2-(2-oxopropyl)cyclohexyl]-2-propenal 2-[(1S,2S)-2-(2-oxopropyl)cyclohexyl]prop-2-enal 2-[(1S,2S)-2-acetonylcyclohexyl]prop-2-enal 2-[(1S,2S)-2-(2-oxidanylidenepropyl)cyclohexyl]prop-2-enal
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-9(8-13)12-6-4-3-5-11(12)7-10(2)14/h8,11-12H,1,3-7H2,2H3/t11-,12+/m0/s1
InChIKey GKFBUYKMVFJCMR-NWDGAFQWSA-N
Molecular Weight 194.274 g/mol
SMILES C([C@@]1([C@](CC(=O)C)(CCCC1)[H])[H])(=C)C=O
SPLASH splash10-0006-0900000000-78d34d6aac4ee9dc9a5e
Source of Spectrum F-53-855-23
Wiley ID 800220