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3α,21-dihydroxy-5β-pregn-16-ene-11,20-dione

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

3α,21-dihydroxy-5β-pregn-16-ene-11,20-dione
SpectraBase Compound ID CwZDyErXjQ0
InChI InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h6,12-15,19,22-23H,3-5,7-11H2,1-2H3/t12-,13-,14+,15+,19-,20+,21+/m1/s1
InChIKey QQTJGVVFZCDSHK-ZJXGYQIJSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 635OGF54kuj
Name 3α,21-dihydroxy-5β-pregn-16-ene-11,20-dione
Source of Sample M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h6,12-15,19,22-23H,3-5,7-11H2,1-2H3/t12-,13-,14+,15+,19-,20+,21+/m1/s1
InChIKey QQTJGVVFZCDSHK-ZJXGYQIJSA-N
Melting Point 184.5C
Molecular Weight 346.47
Technique KBr WAFER