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2H-Benzocyclohepten-2-one, 3,4,4a,5,6,7,8,9-octahydro-4a-methyl-, (S)-
SpectraBase Compound ID C2YLlJY5arT
InChI InChI=1S/C12H18O/c1-12-7-4-2-3-5-10(12)9-11(13)6-8-12/h9H,2-8H2,1H3
InChIKey FIRYVNFRBPOEGB-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IlZCsZke760
Name 2H-Benzocyclohepten-2-one, 3,4,4a,5,6,7,8,9-octahydro-4a-methyl-, (S)-
CAS Registry Number 55103-71-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-12-7-4-2-3-5-10(12)9-11(13)6-8-12/h9H,2-8H2,1H3
InChIKey FIRYVNFRBPOEGB-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C12(C)C(=CC(CC2)=O)CCCCC1
SPLASH splash10-002f-9500000000-b05587f9c0301324de3a
Source of Spectrum SD-1981-0-0
Synonyms 1,11-Dehydro-10-oxo-7-methylbicyclo[5.4.0]undecane 4a-Methyl-3,4,4a,5,6,7,8,9-octahydro-2H-benzo[a]cyclohepten-2-one 4a-methyl-4,5,6,7,8,9-hexahydro-3H-benzocyclohepten-2-one 4a-methyl-4,5,6,7,8,9-hexahydro-3H-benzo[7]annulen-2-one
Wiley ID 1174634