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19,19,19-TRIFLUORO-14-BETA-HYDROXYANDROSTA-4,9-(11)-DIENE-3,17-DIONE
SpectraBase Compound ID EgIO350GhW8
InChI InChI=1S/C19H21F3O3/c1-16-7-5-13-14(18(16,25)9-6-15(16)24)3-2-11-10-12(23)4-8-17(11,13)19(20,21)22/h5,10,14,25H,2-4,6-9H2,1H3/t14-,16-,17-,18+/m1/s1
InChIKey OZAWMPPXEXSWJA-DDBAPUKQSA-N
Mol Weight 354.37 g/mol
Molecular Formula C19H21F3O3
Exact Mass 354.144279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nk6d3e27MZ
Name (8R,10R,13S,14S)-13-methyl-14-oxidanyl-10-(trifluoromethyl)-1,2,6,7,8,12,15,16-octahydrocyclopenta[a]phenanthrene-3,17-dione
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Formula C19H21F3O3
InChI InChI=1S/C19H21F3O3/c1-16-7-5-13-14(18(16,25)9-6-15(16)24)3-2-11-10-12(23)4-8-17(11,13)19(20,21)22/h5,10,14,25H,2-4,6-9H2,1H3/t14-,16-,17-,18+/m1/s1
InChIKey OZAWMPPXEXSWJA-DDBAPUKQSA-N
Molecular Weight 354.369 g/mol
SMILES O[C@]12[C@]3(C([C@@]4(C(=CC(CC4)=O)CC3)C(F)(F)F)=CC[C@@]2(C(=O)CC1)C)[H]
SPLASH splash10-03di-0930000000-474f8fe90dc915e1543f
Source of Spectrum KC-0-1918-16
Synonyms (8R,10R,13S,14S)-14-hydroxy-13-methyl-10-(trifluoromethyl)-1,2,6,7,8,12,15,16-octahydrocyclopenta[a]phenanthrene-3,17-dione (8R,10R,13S,14S)-14-hydroxy-13-methyl-10-(trifluoromethyl)-1,2,6,7,8,12,15,16-octahydrocyclopenta[a]phenanthrene-3,17-quinone
Wiley ID 822880