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6β-Hydroxydianabol
SpectraBase Compound ID 9DkJNrTC3kQ
InChI InChI=1S/C20H28O3/c1-18-7-4-12(21)10-16(18)17(22)11-13-14(18)5-8-19(2)15(13)6-9-20(19,3)23/h4,7,10,13-15,17,22-23H,5-6,8-9,11H2,1-3H3/t13-,14+,15+,17-,18-,19+,20+/m1/s1
InChIKey OBCJFTMGLMNCTJ-INIPNLRTSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1ENXP2Yaa8
Name (6R,8R,9S,10R,13S,14S,17S)-10,13,17-trimethyl-6,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
Alternate Name(s) (6R,8R,9S,10R,13S,14S,17S)-6,17-dihydroxy-10,13,17-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
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Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-18-7-4-12(21)10-16(18)17(22)11-13-14(18)5-8-19(2)15(13)6-9-20(19,3)23/h4,7,10,13-15,17,22-23H,5-6,8-9,11H2,1-3H3/t13-,14+,15+,17-,18-,19+,20+/m1/s1
InChIKey OBCJFTMGLMNCTJ-INIPNLRTSA-N
Molecular Weight 316.441 g/mol
SMILES O[C@@]1(C[C@@]2([C@](CC[C@@]3([C@](CC[C@@]23[H])(O)C)C)([C@@]2(C1=CC(C=C2)=O)C)[H])[H])[H]
SPLASH splash10-0abc-2921000000-a1cb5ed743447b82f96d
Source of Spectrum O-31-309-0
Wiley ID 1317107