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3.BETA.-ETHYL-3.ALPHA.,17.BETA.-DIHYDROXY-5.ALPHA.-ANDROSTANE
SpectraBase Compound ID K950BprIZRk
InChI InChI=1S/C21H36O2/c1-4-21(23)12-11-19(2)14(13-21)5-6-15-16-7-8-18(22)20(16,3)10-9-17(15)19/h14-18,22-23H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19-,20-,21+/m0/s1
InChIKey LLYZBWQKINZAKR-UAMJIQGISA-N
Mol Weight 320.5 g/mol
Molecular Formula C21H36O2
Exact Mass 320.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKYD5Rrmd2d
Name 3.BETA.-ETHYL-3.ALPHA.,17.BETA.-DIHYDROXY-5.ALPHA.-ANDROSTANE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 320.271530397 u
Formula C21H36O2
InChI InChI=1S/C21H36O2/c1-4-21(23)12-11-19(2)14(13-21)5-6-15-16-7-8-18(22)20(16,3)10-9-17(15)19/h14-18,22-23H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19-,20-,21+/m0/s1
InChIKey LLYZBWQKINZAKR-UAMJIQGISA-N
Molecular Weight 320.517 g/mol
Nominal Mass 320 u
Number of Peaks 87
SMILES O[C@@]1([C@]2(CC[C@@]3([C@]4(CC[C@](C[C@@]4(CC[C@]3([C@@]2(CC1)[H])[H])[H])(O)CC)C)[H])C)[H]
SPLASH splash10-052f-9430000000-bebb554c7c836ead409a
Source File Reference LMCM-96959-529E
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Synonyms 3.BETA.-ETHYL-5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL 3-ETHYLANDROSTANE-3,17-DIOL (3R,5S,8R,9S,10S,13S,14S,17S)-3-ethyl-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Wiley ID 4_494