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5.ALPHA.-ANDROSTANE-3.BETA.,11.ALPHA.,16.BETA.-TRIOL
SpectraBase Compound ID LP6l1oZpvT9
InChI InChI=1S/C19H32O3/c1-18-9-13(21)8-15(18)14-4-3-11-7-12(20)5-6-19(11,2)17(14)16(22)10-18/h11-17,20-22H,3-10H2,1-2H3/t11-,12-,13-,14-,15-,16+,17+,18-,19-/m0/s1
InChIKey OFQPAMJJKUDBSN-SWBZIKIXSA-N
Mol Weight 308.5 g/mol
Molecular Formula C19H32O3
Exact Mass 308.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87kHi3xVNcn
Name 5.ALPHA.-ANDROSTANE-3.BETA.,11.ALPHA.,16.BETA.-TRIOL
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 308.235144887 u
Formula C19H32O3
InChI InChI=1S/C19H32O3/c1-18-9-13(21)8-15(18)14-4-3-11-7-12(20)5-6-19(11,2)17(14)16(22)10-18/h11-17,20-22H,3-10H2,1-2H3/t11-,12-,13-,14-,15-,16+,17+,18-,19-/m0/s1
InChIKey OFQPAMJJKUDBSN-SWBZIKIXSA-N
Molecular Weight 308.462 g/mol
Nominal Mass 308 u
Number of Peaks 118
SMILES O[C@@]1(C[C@]2(C[C@]([C@@]3([C@]4(CC[C@@](C[C@@]4(CC[C@]3([C@@]2(C1)[H])[H])[H])(O)[H])C)[H])(O)[H])C)[H]
SPLASH splash10-05fu-1390000000-c57207d77e3ff6c39e8e
Source File Reference LMCM-14658-132C
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROSTANE-3,11,16-TRIOL (3S,5S,8S,9S,10S,11R,13S,14S,16S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,11,16-triol
Wiley ID 4_25