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4,8-Methanoazulen-5(1H)-one, octahydro-, (3a.alpha.,4.beta.,8.beta.,8a.alpha.)-
SpectraBase Compound ID 8of6gu9x6im
InChI InChI=1S/C11H16O/c12-11-5-4-7-6-10(11)9-3-1-2-8(7)9/h7-10H,1-6H2/t7-,8-,9-,10+/m1/s1
InChIKey LDQFYAZPYJOJJK-KYXWUPHJSA-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 CKCgcHKFpLg
Name 4,8-Methanoazulen-5(1H)-one, octahydro-, (3a.alpha.,4.beta.,8.beta.,8a.alpha.)-
CAS Registry Number 53432-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c12-11-5-4-7-6-10(11)9-3-1-2-8(7)9/h7-10H,1-6H2/t7-,8-,9-,10+/m1/s1
InChIKey LDQFYAZPYJOJJK-KYXWUPHJSA-N
Molecular Weight 164.248 g/mol
SMILES [C@]12([C@]3([C@@](CCC3)([H])[C@](C1)([H])CCC2=O)[H])[H]
SPLASH splash10-004i-9700000000-ffb4cbe243ac9f9fda6c
Source of Spectrum I-62-1765-0
Synonyms (1S,2R,6R,7R)-tricyclo[5.3.1.0(2,6)]undecan-8-one Anti-5-tert-butyltricyclo[2.2.1.0(2,6)]heptan-3-one syn-5-tert-butyltricyclo[2.2.1.0(2,6)]heptan-3-one
Wiley ID 1160834