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Pregna-1,4-diene-3,20-dione, 17-hydroxy-
SpectraBase Compound ID 53hRgjKvsqN
InChI InChI=1S/C21H28O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h6,9,12,16-18,24H,4-5,7-8,10-11H2,1-3H3
InChIKey JQVUIHNKYYECGH-UHFFFAOYSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A75V3Nvma
Name Pregna-1,4-diene-3,20-dione, 17-hydroxy-
Alternate Name(s) 17-acetyl-17-hydroxy-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one 17-ethanoyl-10,13-dimethyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one 17-Hydroxypregna-1,4-diene-3,20-dione 17.alpha.-Hydroxy-pregna-1,4-diene-3,20-dione BRN 2223189 NSC 9786
CAS Registry Number 2477-61-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h6,9,12,16-18,24H,4-5,7-8,10-11H2,1-3H3
InChIKey JQVUIHNKYYECGH-UHFFFAOYSA-N
Molecular Weight 328.452 g/mol
SMILES OC1(CCC2C1(C)CCC1C2CCC=2C1(C)C=CC(C2)=O)C(C)=O
SPLASH splash10-006x-7931000000-a29cacd4cd6a857a1e81
Source of Spectrum O-13-651-6
Wiley ID 1326664