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3H-Benz[e]inden-3-one, dodecahydro-3a-methyl-, (3a.alpha.,5a.alpha.,9a.beta.,9b.alpha.)-
SpectraBase Compound ID CkFSx3kpORK
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+/m0/s1
InChIKey RKRSGCDFBKVKDZ-KZVDOYCCSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3p4KZNCiGnC
Name 3H-Benz[e]inden-3-one, dodecahydro-3a-methyl-, (3a.alpha.,5a.alpha.,9a.beta.,9b.alpha.)-
CAS Registry Number 87900-50-3
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+/m0/s1
InChIKey RKRSGCDFBKVKDZ-KZVDOYCCSA-N
Molecular Weight 206.329 g/mol
SMILES [C@]12([C@]([C@@]3(CCCC[C@]3(CC2)[H])[H])(CCC1=O)[H])C
SPLASH splash10-01vt-1910000000-c88609921f1fb832bd05
Source of Spectrum J-49-156-0
Synonyms (3a.alpha.,5a.alpha.,9a.beta.,9b.alpha.)-dodecahydro-3a-methyl-3H-benz[e]inden-3-one (3aR,5aS,9aR,9bS)-3a-methyldodecahydro-3H-cyclopenta[a]naphthalen-3-one
Wiley ID 1205089