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2-[(1S,2S)-2-(2-oxopropyl)cyclohexyl]-2-propenoic acid ethyl ester
SpectraBase Compound ID D6sreuz2tVR
InChI InChI=1S/C14H22O3/c1-4-17-14(16)11(3)13-8-6-5-7-12(13)9-10(2)15/h12-13H,3-9H2,1-2H3/t12-,13+/m0/s1
InChIKey PPQYOVOXFNSBJJ-QWHCGFSZSA-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 KnxoDAL7LK2
Name 2-[(1S,2S)-2-(2-oxopropyl)cyclohexyl]-2-propenoic acid ethyl ester
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Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-4-17-14(16)11(3)13-8-6-5-7-12(13)9-10(2)15/h12-13H,3-9H2,1-2H3/t12-,13+/m0/s1
InChIKey PPQYOVOXFNSBJJ-QWHCGFSZSA-N
Molecular Weight 238.327 g/mol
SMILES C([C@@]1([C@](CC(=O)C)(CCCC1)[H])[H])(C(=O)OCC)=C
SPLASH splash10-000l-0900000000-6e3e5bdcbf4f0f877011
Source of Spectrum F-53-854-5
Synonyms 2-[(1S,2S)-2-acetonylcyclohexyl]acrylic acid ethyl ester Ethyl 2-[(1S,2S)-2-(2-oxidanylidenepropyl)cyclohexyl]prop-2-enoate Ethyl 2-[(1S,2S)-2-(2-oxopropyl)cyclohexyl]prop-2-enoate Ethyl 2-[(1S,2S)-2-acetonylcyclohexyl]prop-2-enoate
Wiley ID 800226