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Pregnan-11-one, (5.beta.)-
SpectraBase Compound ID 2hTg1a14KZc
InChI InChI=1S/C21H34O/c1-4-14-9-11-17-16-10-8-15-7-5-6-12-20(15,2)19(16)18(22)13-21(14,17)3/h14-17,19H,4-13H2,1-3H3
InChIKey DIRFKRKDYVZWDV-UHFFFAOYSA-N
Mol Weight 302.5 g/mol
Molecular Formula C21H34O
Exact Mass 302.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10LNdCt9V06
Name Pregnan-11-one, (5.beta.)-
Alternate Name(s) Pregnan-11-one 17-ethyl-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one Pregnan-11-one, (5.alpha.)- 5.alpha.-Pregnan-11-one 5.beta.-Pregnan-11-one
CAS Registry Number 26729-46-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O
InChI InChI=1S/C21H34O/c1-4-14-9-11-17-16-10-8-15-7-5-6-12-20(15,2)19(16)18(22)13-21(14,17)3/h14-17,19H,4-13H2,1-3H3
InChIKey DIRFKRKDYVZWDV-UHFFFAOYSA-N
Molecular Weight 302.502 g/mol
SMILES CCC1CCC2C1(CC(=O)C1C2CCC2C1(CCCC2)C)C
SPLASH splash10-052f-5921000000-611a367a29b1a418e5da
Source of Spectrum C-84-1433-7
Wiley ID 1305253