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(5S)-6-Hydroxymethylene-5-isopropenyl-2-methyl-2-cyclohexenone
SpectraBase Compound ID 23NikMOL4H7
InChI InChI=1S/C11H14O2/c1-7(2)9-5-4-8(3)11(13)10(9)6-12/h4,6,9-10H,1,5H2,2-3H3/t9-,10-/m0/s1
InChIKey RQYLJSFUEKSAEO-UWVGGRQHSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Itc4vrQhP3T
Name (5S)-6-Hydroxymethylene-5-isopropenyl-2-methyl-2-cyclohexenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-7(2)9-5-4-8(3)11(13)10(9)6-12/h4,6,9-10H,1,5H2,2-3H3/t9-,10-/m0/s1
InChIKey RQYLJSFUEKSAEO-UWVGGRQHSA-N
Molecular Weight 178.231 g/mol
SMILES [C@@]1(C(C(C)=CC[C@]1(C(=C)C)[H])=O)(C=O)[H]
SPLASH splash10-0a6r-2900000000-76e810527f6595dcdb04
Source of Spectrum F-56-2082-1
Synonyms (5R,6R)-6-Carbaldehyde-5-isopropenyl-2-methyl-2-cyclohexenone (5S,6E)-6-(hydroxymethylene)-5-isopropenyl-2-methyl-2-cyclohexen-1-one
Wiley ID 856402