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Pregn-4-ene-3,20-dione, 17,21-dihydroxy-

View entire compound with spectra: 5 NMR, and 1 MS (GC)

Pregn-4-ene-3,20-dione, 17,21-dihydroxy-
SpectraBase Compound ID 5W5SBXmhlvu
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3
InChIKey WHBHBVVOGNECLV-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABsWM9PAcmM
Name
CAS Registry Number 152-58-9
Comments 17-OH B
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3
InChIKey WHBHBVVOGNECLV-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference M.D. Gonzalez, G. Burton, Org. Magn. Resonance 22, 586 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3