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7.alpha.-Methyl-(1H.beta.,6H.beta.)-bicyclo[4.4.1]undeca-2,4,8-trien-11-one
SpectraBase Compound ID H6B6Z3JM6T8
InChI InChI=1S/C12H14O/c1-9-5-4-7-10-6-2-3-8-11(9)12(10)13/h2-6,8-11H,7H2,1H3/t9-,10+,11+/m0/s1
InChIKey IEJNXBNSZQNMIE-GMTAPVOTSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5Jwv9cglFn
Name 7.alpha.-Methyl-(1H.beta.,6H.beta.-bicyclo[4.4.1]undeca-2,4,8-trien-11-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-9-5-4-7-10-6-2-3-8-11(9)12(10)13/h2-6,8-11H,7H2,1H3/t9-,10+,11+/m0/s1
InChIKey IEJNXBNSZQNMIE-GMTAPVOTSA-N
Molecular Weight 174.243 g/mol
SMILES C1([C@@]2(C=CC=C[C@@]1(CC=C[C@@]2(C)[H])[H])[H])=O
SPLASH splash10-0a4i-0900000000-4072d3b23a010278107e
Source of Spectrum C-115-1394-0
Synonyms 7.alpha.-Methyl-(1H.beta.,6H.beta.)-bicyclo[4.4.1]undeca-2,4,8-trien-11-one (1S,6R,7R)-7-methylbicyclo[4.4.1]undeca-2,4,8-trien-11-one
Wiley ID 1171083