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Androst-5-ene-3,17-diol
SpectraBase Compound ID 3aO7lPY6uMw
InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-17,20-21H,4-11H2,1-2H3/t13?,14-,15-,16-,17?,18-,19-/m0/s1
InChIKey QADHLRWLCPCEKT-WJWLXVOASA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JfI8bI5Dha
Name ANDROST-5-ENE-3,17-DIOL
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 290.224580204 u
Formula C19H30O2
InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-17,20-21H,4-11H2,1-2H3/t13?,14-,15-,16-,17?,18-,19-/m0/s1
InChIKey QADHLRWLCPCEKT-WJWLXVOASA-N
Molecular Weight 290.447 g/mol
Nominal Mass 290 u
Number of Peaks 226
SMILES OC1[C@]2(CC[C@@]3([C@]4(CCC(CC4=CC[C@]3([C@@]2(CC1)[H])[H])O)C)[H])C
SPLASH splash10-052f-6950000000-6b731f7766dfcef18344
Source File Reference LMCM-50076-489Y
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (1S,2R,10R,11S,15S)-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-ene-5,14-diol
Wiley ID 8_11391