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ANDROST-5-ENE-3,17,19-TRIOL
SpectraBase Compound ID 1nWXa3ZbJPL
InChI InChI=1S/C19H30O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h2,13-17,20-22H,3-11H2,1H3/t13?,14-,15-,16-,17?,18-,19+/m0/s1
InChIKey KPTQFNUKAKVGSS-BDLGILGFSA-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 1MkgCw6U1ly
Name ANDROST-5-ENE-3,17,19-TRIOL
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 306.219494823 u
Formula C19H30O3
InChI InChI=1S/C19H30O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h2,13-17,20-22H,3-11H2,1H3/t13?,14-,15-,16-,17?,18-,19+/m0/s1
InChIKey KPTQFNUKAKVGSS-BDLGILGFSA-N
Molecular Weight 306.446 g/mol
Nominal Mass 306 u
Number of Peaks 258
SMILES OC1[C@]2(CC[C@@]3([C@]4(CCC(CC4=CC[C@]3([C@@]2(CC1)[H])[H])O)CO)[H])C
SPLASH splash10-0a4r-3980000000-ab99683f6c8a824e5a97
Source File Reference LMCM-60237-620M
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (1S,2S,10R,11S,15S)-2-(hydroxymethyl)-15-methyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-ene-5,14-diol
Wiley ID 8_12701