For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3H-Benz[e]inden-3-one, dodecahydro-3a-methyl-, (3a.alpha.,5a.beta.,9a.alpha.,9b.beta.)-
SpectraBase Compound ID KO55MFyD1X8
InChI InChI=1S/C14H22O/c1-14-9-8-10-4-2-3-5-11(10)12(14)6-7-13(14)15/h10-12H,2-9H2,1H3/t10-,11+,12-,14-/m1/s1
InChIKey RKRSGCDFBKVKDZ-GFQSEFKGSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8U4QbH0e0ue
Name 3H-Benz[e]inden-3-one, dodecahydro-3a-methyl-, (3a.alpha.,5a.beta.,9a.alpha.,9b.beta.)-
CAS Registry Number 87900-49-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-14-9-8-10-4-2-3-5-11(10)12(14)6-7-13(14)15/h10-12H,2-9H2,1H3/t10-,11+,12-,14-/m1/s1
InChIKey RKRSGCDFBKVKDZ-GFQSEFKGSA-N
Molecular Weight 206.329 g/mol
SMILES [C@]12([C@@]([C@]3(CCCC[C@@]3(CC2)[H])[H])(CCC1=O)[H])C
SPLASH splash10-06rj-0910000000-d84e832b6545e43d9acb
Source of Spectrum J-49-156-0
Synonyms (3a.alpha.,5a.beta.,9a.alpha.,9b.beta.)-dodecahydro-3a-methyl-3H-benz[e]inden-3-one (3aR,5aR,9aS,9bR)-3a-methyldodecahydro-3H-cyclopenta[a]naphthalen-3-one
Wiley ID 1205090