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3.beta.-Hydroxy-14.beta.,17.alpha.-pregn-5-en-20-one
SpectraBase Compound ID BIQqi4fK31q
InChI InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15-,16-,17-,18+,19-,20-,21+/m0/s1
InChIKey ORNBQBCIOKFOEO-MTUNSFAGSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gipskSlKBD
Name 3.beta.-Hydroxy-14.beta.,17.alpha.-pregn-5-en-20-one
Alternate Name(s) (3beta,14beta,17alpha)-3-hydroxypregn-5-en-20-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15-,16-,17-,18+,19-,20-,21+/m0/s1
InChIKey ORNBQBCIOKFOEO-MTUNSFAGSA-N
Molecular Weight 316.485 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@@]([C@@]3(CC=C2C1)[H])(CC[C@]4(C(=O)C)[H])[H])C)[H])C)[H]
SPLASH splash10-0aos-4943000000-5f812c2bc4f86628026e
Source of Spectrum G-59-2702-0
Wiley ID 748754