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3.alpha.-Fluoro-5.alpha.-androstan-17-one
SpectraBase Compound ID 9cNcZaWQlkT
InChI InChI=1S/C19H29FO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1
InChIKey XSBKZRQOPNVGLF-HLUDHZFRSA-N
Mol Weight 292.44 g/mol
Molecular Formula C19H29FO
Exact Mass 292.220244 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wyvtQ3a8N1
Name 3.alpha.-Fluoro-5.alpha.-androstan-17-one
Alternate Name(s) (3R,5S,8R,9S,10S,13S,14S)-3-fluoranyl-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one (3R,5S,8R,9S,10S,13S,14S)-3-fluoro-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
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Formula C19H29FO
InChI InChI=1S/C19H29FO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1
InChIKey XSBKZRQOPNVGLF-HLUDHZFRSA-N
Molecular Weight 292.438 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CC[C@]2(C[C@@](CC1)(F)[H])[H])[H])C
SPLASH splash10-0006-9240000000-419d9febab8793874b2b
Source of Spectrum G-73-1832-10
Wiley ID 1693148