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5β-pregnane-3α,6α,20β,21-tetrol

View entire compound with spectra: 2 FTIR

5β-pregnane-3α,6α,20β,21-tetrol
SpectraBase Compound ID J9h9rODcAGC
InChI InChI=1S/C21H36O4/c1-20-8-6-15-13(14(20)3-4-16(20)19(25)11-22)10-18(24)17-9-12(23)5-7-21(15,17)2/h12-19,22-25H,3-11H2,1-2H3/t12-,13+,14+,15+,16-,17+,18+,19-,20+,21-/m1/s1
InChIKey RJDYIPZGCOQSMW-LXIRAYIGSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LXmVi7uc823
Name 5β-pregnane-3α,6α,20β,21-tetrol
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 C21H36O4
InChI InChI=1S/C21H36O4/c1-20-8-6-15-13(14(20)3-4-16(20)19(25)11-22)10-18(24)17-9-12(23)5-7-21(15,17)2/h12-19,22-25H,3-11H2,1-2H3/t12-,13+,14+,15+,16-,17+,18+,19-,20+,21-/m1/s1
InChIKey RJDYIPZGCOQSMW-LXIRAYIGSA-N
Melting Point 291-293C
Molecular Weight 352.52
Technique KBr WAFER