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5β-Pregnan-3β,17β-diol-20-one

View entire compound with spectra: 1 NMR, 3 FTIR, and 1 Raman

5β-Pregnan-3β,17β-diol-20-one
SpectraBase Compound ID 6uIGoZKt6FD
InChI InChI=1S/C21H34O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h14-18,23-24H,4-12H2,1-3H3/t14-,15+,16-,17+,18+,19+,20+,21+/m1/s1
InChIKey LKQDFQLSEHWIRK-GNPNMZQZSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AvU5hlMMMu8
Name 5β-Pregnan-3β,17β-diol-20-one
Source of Sample John J. Schneider, Jefferson Medical College, Philadelphia, Pennsylvania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h14-18,23-24H,4-12H2,1-3H3/t14-,15+,16-,17+,18+,19+,20+,21+/m1/s1
InChIKey LKQDFQLSEHWIRK-GNPNMZQZSA-N
Molecular Weight 334.50
Technique KBr WAFER