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(5S)-6-Hydroxymethylene-5-isopropenyl-2,2-dimethylcyclohexanone
SpectraBase Compound ID JpNpQZmTRS3
InChI InChI=1S/C12H18O2/c1-8(2)9-5-6-12(3,4)11(14)10(9)7-13/h7,9,13H,1,5-6H2,2-4H3/b10-7+/t9-/m0/s1
InChIKey PTWGLXKZQHGDKE-HZAKCSEPSA-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 3SCnRekmDqm
Name (5S)-6-Hydroxymethylene-5-isopropenyl-2,2-dimethylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-8(2)9-5-6-12(3,4)11(14)10(9)7-13/h7,9,13H,1,5-6H2,2-4H3/b10-7+/t9-/m0/s1
InChIKey PTWGLXKZQHGDKE-HZAKCSEPSA-N
Molecular Weight 194.274 g/mol
SMILES O\C=C\1C(C(CC[C@]1(C(=C)C)[H])(C)C)=O
SPLASH splash10-0006-5900000000-7d4fdb50a8d5ec49eb64
Source of Spectrum F-56-2083-11
Synonyms (5S,6E)-6-(hydroxymethylene)-5-isopropenyl-2,2-dimethylcyclohexanone
Wiley ID 856391