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11-BETA,17-ALPHA-DIHYDROXYPREGNA-1,4-DIEN-3,20-DION
SpectraBase Compound ID 7ZGSycJJRxL
InChI InChI=1S/C21H28O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h6,8,10,15-18,24-25H,4-5,7,9,11H2,1-3H3/t15-,16-,17-,18+,19-,20-,21-/m0/s1
InChIKey KQZSMOGWYFPKCH-UJPCIWJBSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FT78hVit4Xc
Name 11-BETA,17-ALPHA-DIHYDROXYPREGNA-1,4-DIEN-3,20-DION
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h6,8,10,15-18,24-25H,4-5,7,9,11H2,1-3H3/t15-,16-,17-,18+,19-,20-,21-/m0/s1
InChIKey KQZSMOGWYFPKCH-UJPCIWJBSA-N
Literature Reference Author M.D.GONZALEZ,G.BURTON
Literature Reference Citation ORG.MAGN.RES.,22,586(1984)
Literature Reference DOI 10.1002/mrc.1270220914
Molecular Weight 344.451 g/mol
Solvent CDCl3
Source File Reference UNIW12729