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3,17-DIHYDROXYANDROSTAN-16-ONE
SpectraBase Compound ID CGkU7qO8qlA
InChI InChI=1S/C19H30O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h11-15,17,20,22H,3-10H2,1-2H3/t11?,12?,13-,14+,15+,17?,18+,19+/m1/s1
InChIKey QHSZSKZLCCRGLJ-VCNAQNHDSA-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 1wdzpghXXL5
Name 3,17-DIHYDROXYANDROSTAN-16-ONE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 306.219494823 u
Formula C19H30O3
InChI InChI=1S/C19H30O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h11-15,17,20,22H,3-10H2,1-2H3/t11?,12?,13-,14+,15+,17?,18+,19+/m1/s1
InChIKey QHSZSKZLCCRGLJ-VCNAQNHDSA-N
Molecular Weight 306.446 g/mol
Nominal Mass 306 u
Number of Peaks 244
SMILES OC1[C@]2(CC[C@@]3([C@]4(CCC(CC4CC[C@]3([C@@]2(CC1=O)[H])[H])O)C)[H])C
SPLASH splash10-067i-5593000000-ba2738608b6ca14000d1
Source File Reference LMCM-29088-235H
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (1S,2S,10R,11S,15S)-5,14-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-13-one
Wiley ID 8_10625