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6H-3a,7-Methanoazulen-6-one, octahydro-, (3a.alpha.,7.alpha.,8a.beta.)-
SpectraBase Compound ID vfMe3YDwdK
InChI InChI=1S/C11H16O/c12-10-3-5-11-4-1-2-9(11)6-8(10)7-11/h8-9H,1-7H2/t8-,9+,11+/m1/s1
InChIKey LNHLYOJVHIXTOW-YWVKMMECSA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60BqOJ7TATm
Name 6H-3a,7-Methanoazulen-6-one, octahydro-, (3a.alpha.,7.alpha.,8a.beta.)-
Alternate Name(s) (1S,5S,7S)-tricyclo[5.3.1.0(1,5)]undecan-8-one Tricyclo[5.3.1.0(1,5)]undecan-8-one
CAS Registry Number 91854-70-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c12-10-3-5-11-4-1-2-9(11)6-8(10)7-11/h8-9H,1-7H2/t8-,9+,11+/m1/s1
InChIKey LNHLYOJVHIXTOW-YWVKMMECSA-N
Molecular Weight 164.248 g/mol
SMILES [C@@]123C[C@@]([H])(C[C@@]3(CCC1)[H])C(CC2)=O
SPLASH splash10-0a59-6900000000-e3dda767f2d163720d2f
Source of Spectrum I-62-1162-0
Wiley ID 1160854