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3β-hydroxy-6-methylpregna-5,16-dien-20-one, acetate

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

3β-hydroxy-6-methylpregna-5,16-dien-20-one, acetate
SpectraBase Compound ID 94w82s4TsvC
InChI InChI=1S/C24H34O3/c1-14-12-18-20-7-6-19(15(2)25)23(20,4)11-9-21(18)24(5)10-8-17(13-22(14)24)27-16(3)26/h6,17-18,20-21H,7-13H2,1-5H3/t17-,18-,20-,21-,23+,24+/m0/s1
InChIKey FIFCOJHNNZMPQU-BQGSHDAWSA-N
Mol Weight 370.5 g/mol
Molecular Formula C24H34O3
Exact Mass 370.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6RdGJUtXwHA
Name 3β-hydroxy-6-methylpregna-5,16-dien-20-one, acetate
Source of Sample E. Merck AG, Darmstadt, Germany
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O3
InChI InChI=1S/C24H34O3/c1-14-12-18-20-7-6-19(15(2)25)23(20,4)11-9-21(18)24(5)10-8-17(13-22(14)24)27-16(3)26/h6,17-18,20-21H,7-13H2,1-5H3/t17-,18-,20-,21-,23+,24+/m0/s1
InChIKey FIFCOJHNNZMPQU-BQGSHDAWSA-N
Molecular Weight 370.54
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PREGNA-5,16-DIEN-20-ONE, 3B-HYDROXY-6-METHYL-, ACETATE