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21-Hydroxy-1,4-pregnadiene-3,20-dione

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21-Hydroxy-1,4-pregnadiene-3,20-dione
SpectraBase Compound ID H00jmtSHuXU
InChI InChI=1S/C21H28O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h7,9,11,15-18,22H,3-6,8,10,12H2,1-2H3
InChIKey ZDYFFPNLCUDFDB-UHFFFAOYSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4UGwB7ni4DW
Name 21-Hydroxy-1,4-pregnadiene-3,20-dione
CAS Registry Number 5508-55-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h7,9,11,15-18,22H,3-6,8,10,12H2,1-2H3
InChIKey ZDYFFPNLCUDFDB-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