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5,9-Methano-7H-benzocyclohepten-7-one, 5,6,8,9-tetrahydro-8-hydroxy-6,6-dimethyl-, (5.alpha.,8.alpha.,9.alpha.)-
SpectraBase Compound ID 1ADl1xHg9mf
InChI InChI=1S/C14H16O2/c1-14(2)11-7-10(12(15)13(14)16)8-5-3-4-6-9(8)11/h3-6,10-12,15H,7H2,1-2H3/t10-,11+,12-/m1/s1
InChIKey AOKFAJFGYMNTMW-GRYCIOLGSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJgRL8MJsgF
Name 5,9-Methano-7H-benzocyclohepten-7-one, 5,6,8,9-tetrahydro-8-hydroxy-6,6-dimethyl-, (5.alpha.,8.alpha.,9.alpha.)-
Alternate Name(s) (1R,8S,11R)-11-hydroxy-9,9-dimethyltricyclo[6.3.1.0(2,7)]dodeca-2,4,6-trien-10-one exo-8-hydroxy-6,6-dimethyl-6,7,8,9-tetrahydro-5,9-methano-5H-benzocyclohepten-7-one
CAS Registry Number 67273-36-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-14(2)11-7-10(12(15)13(14)16)8-5-3-4-6-9(8)11/h3-6,10-12,15H,7H2,1-2H3/t10-,11+,12-/m1/s1
InChIKey AOKFAJFGYMNTMW-GRYCIOLGSA-N
Molecular Weight 216.280 g/mol
SMILES O[C@@]1([C@@]2(C[C@](C(C1=O)(C)C)(c1c2cccc1)[H])[H])[H]
SPLASH splash10-014i-0910000000-4fbcaf353bed0c08487d
Source of Spectrum B-31-1138-0
Wiley ID 1215854