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1,4,4a,4b,5,6,10,10a-Octahydro-10a.beta.-hydroxymethyl-4b.beta.,8-dimethyl-3(2H)-phenanthrenone
SpectraBase Compound ID HqNVJDzDrEs
InChI InChI=1S/C17H24O2/c1-12-4-3-7-16(2)14(12)6-9-17(11-18)8-5-13(19)10-15(16)17/h4,6,15,18H,3,5,7-11H2,1-2H3/t15?,16-,17+/m1/s1
InChIKey BVOCZURFVZNIBL-FGJGXXMFSA-N
Mol Weight 260.38 g/mol
Molecular Formula C17H24O2
Exact Mass 260.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8N3FmoyKsX
Name 1,4,4a,4b,5,6,10,10a-Octahydro-10a.beta.-hydroxymethyl-4b.beta.,8-dimethyl-3(2H)-phenanthrenone
Alternate Name(s) (4bS,10aR)-10a-(hydroxymethyl)-4b,8-dimethyl-1,4,4a,4b,5,6,10,10a-octahydro-3(2H)-phenanthrenone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O2
InChI InChI=1S/C17H24O2/c1-12-4-3-7-16(2)14(12)6-9-17(11-18)8-5-13(19)10-15(16)17/h4,6,15,18H,3,5,7-11H2,1-2H3/t15?,16-,17+/m1/s1
InChIKey BVOCZURFVZNIBL-FGJGXXMFSA-N
Molecular Weight 260.377 g/mol
SMILES OC[C@]12C([C@]3(C(=CC2)C(C)=CCC3)C)CC(=O)CC1
SPLASH splash10-03di-0090000000-5841f15eb57aa22fda74
Source of Spectrum AJ-61-3600-55
Wiley ID 1264186