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5.alpha.,6.alpha.-Epoxypregnan-3.beta.-ol
SpectraBase Compound ID 2hFFVm87Y7e
InChI InChI=1S/C21H34O2/c1-4-13-5-6-16-15-11-18-21(23-18)12-14(22)7-10-20(21,3)17(15)8-9-19(13,16)2/h13-18,22H,4-12H2,1-3H3/t13-,14-,15-,16-,17-,18-,19+,20+,21-/m0/s1
InChIKey QVARGDILUJYXSO-UXXFREBZSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13z9AekYj2
Name 5.alpha.,6.alpha.-Epoxypregnan-3.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-4-13-5-6-16-15-11-18-21(23-18)12-14(22)7-10-20(21,3)17(15)8-9-19(13,16)2/h13-18,22H,4-12H2,1-3H3/t13-,14-,15-,16-,17-,18-,19+,20+,21-/m0/s1
InChIKey QVARGDILUJYXSO-UXXFREBZSA-N
Molecular Weight 318.501 g/mol
SMILES O[C@@]1(C[C@@]23O[C@]3(C[C@@]3([C@@]([C@]2(CC1)C)(CC[C@@]1([C@@](CC)(CC[C@@]31[H])[H])C)[H])[H])[H])[H]
SPLASH splash10-05mo-9512000000-f7204bcb4ec30ac76d15
Source of Spectrum PS-50-1736-7
Synonyms (3S,4aR,5aS,6aS,6bS,9S,9aR,11aS,11bR)-9-ethyl-9a,11b-dimethylhexadecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-3-ol
Wiley ID 1319027