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3,11-Dihydroxyandrostan-17-one
SpectraBase Compound ID AOvhR1BjIAA
InChI InChI=1S/C19H30O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12+,13-,14-,15+,17+,18-,19-/m0/s1
InChIKey PIXFHVWJOVNKQK-CJWOFWMHSA-N
Mol Weight 306.45 g/mol
Molecular Formula C19H30O3
Exact Mass 306.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NlCL8pXWvk
Name 3.ALPHA.,11.ALPHA.-DIHYDROXY-5.ALPHA.-ANDROSTAN-17-ONE
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Exact Mass 306.219494823 u
Formula C19H30O3
InChI InChI=1S/C19H30O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12+,13-,14-,15+,17+,18-,19-/m0/s1
InChIKey PIXFHVWJOVNKQK-CJWOFWMHSA-N
Molecular Weight 306.446 g/mol
Nominal Mass 306 u
Number of Peaks 135
SMILES O[C@]1([C@@]2([C@]3(CC[C@](C[C@@]3(CC[C@]2([C@@]2(CCC([C@]2(C1)C)=O)[H])[H])[H])(O)[H])C)[H])[H]
SPLASH splash10-0a4i-9821000000-3169e9e41ea10c8c2f4d
Source File Reference LMCM-97054-409Z
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Synonyms 3,11-DIHYDROXYANDROSTAN-17-ONE (3R,5S,8S,9S,10S,11R,13S,14S)-3,11-dihydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
Wiley ID 4_439