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4a.beta.,8.alpha.-Dimethyl-1,2,3,4,4a,4b.beta.,5,8-octahydro-9(8a.beta.H)-phenanthrenone
SpectraBase Compound ID 6ssJ9VTlDtG
InChI InChI=1S/C16H22O/c1-11-6-5-8-13-15(11)14(17)10-12-7-3-4-9-16(12,13)2/h5-6,10-11,13,15H,3-4,7-9H2,1-2H3/t11-,13+,15-,16-/m0/s1
InChIKey UWAFUNNOFBTRLE-YOENINGUSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lA4Qcd4nZQ
Name 4a.beta.,8.alpha.-Dimethyl-1,2,3,4,4a,4b.beta.,5,8-octahydro-9(8a.beta.H)-phenanthrenone
Alternate Name(s) (4aR,4bR,8S,8aS)-4a,8-dimethyl-2,3,4,4a,4b,5,8,8a-octahydro-9(1H)-phenanthrenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-11-6-5-8-13-15(11)14(17)10-12-7-3-4-9-16(12,13)2/h5-6,10-11,13,15H,3-4,7-9H2,1-2H3/t11-,13+,15-,16-/m0/s1
InChIKey UWAFUNNOFBTRLE-YOENINGUSA-N
Molecular Weight 230.351 g/mol
SMILES [C@]12([C@]3([C@@]([C@@](C)(C=CC3)[H])([H])C(C=C1CCCC2)=O)[H])C
SPLASH splash10-00b9-8910000000-9f14923d9f4a30f45cb5
Source of Spectrum J-56-5356-8
Wiley ID 1232352