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17Alpha-Pregna-4,20-dien-3-one
SpectraBase Compound ID 2Po1cbIoIK4
InChI InChI=1S/C21H30O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h4,13-14,17-19H,1,5-12H2,2-3H3/t14-,17-,18-,19-,20+,21-/m0/s1
InChIKey CSFSHOOQUIPHRO-NWSAAYAGSA-N
Mol Weight 298.47 g/mol
Molecular Formula C21H30O
Exact Mass 298.229666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7X3cquVsSA
Name 17-ALPHA-PREGNA-4,20-DIEN-3-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O
InChI InChI=1S/C21H30O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h4,13-14,17-19H,1,5-12H2,2-3H3/t14-,17-,18-,19-,20+,21-/m0/s1
InChIKey CSFSHOOQUIPHRO-NWSAAYAGSA-N
Literature Reference Author S.L.WU,G.H.WANG,C.F.DAI,J.H.SHEU
Literature Reference Citation J.CHIN.CHEM.SOC.,51,205(2004)
Literature Reference DOI 10.1002/jccs.200400031
Molecular Weight 298.469 g/mol
Solvent CDCl3
Source File Reference UWLU5442