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4a,7-Methano-4aH-benzocyclohepten-10-one, 3,4,5,6,7,8,9,9a-octahydro-6,6-dimethyl-, (4a.alpha.,7.alpha.,9a.alpha.)-(.+-.)-
SpectraBase Compound ID 3qLGwxmb0Mp
InChI InChI=1S/C14H20O/c1-13(2)9-14-8-4-3-5-10(14)6-7-11(13)12(14)15/h3,5,10-11H,4,6-9H2,1-2H3/t10-,11-,14+/m1/s1
InChIKey WJQYXDNCDRSMTB-GYSYKLTISA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9AhG2ju3yx
Name 4a,7-Methano-4aH-benzocyclohepten-10-one, 3,4,5,6,7,8,9,9a-octahydro-6,6-dimethyl-, (4a.alpha.,7.alpha.,9a.alpha.)-(.+-.)-
Alternate Name(s) (1R+,6R+,9R+)-10,10-dimethyl-12-oxo-tricyclo[7.2.2.0]dodec-4-ene (1S,6S,9R)-10,10-dimethyltricyclo[7.2.1.0(1,6)]dodec-4-en-12-one
CAS Registry Number 85083-90-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-13(2)9-14-8-4-3-5-10(14)6-7-11(13)12(14)15/h3,5,10-11H,4,6-9H2,1-2H3/t10-,11-,14+/m1/s1
InChIKey WJQYXDNCDRSMTB-GYSYKLTISA-N
Molecular Weight 204.313 g/mol
SMILES [C@]123C([C@]([H])(C(C3)(C)C)CC[C@]1(C=CCC2)[H])=O
SPLASH splash10-001i-0940000000-e8384d16f72d09ad883a
Source of Spectrum F-39-3242-0
Wiley ID 1202320