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5a-Androstane-3beta,17beta-diol hydrate

View entire compound with spectra: 4 NMR, and 2 FTIR

5a-Androstane-3beta,17beta-diol hydrate
SpectraBase Compound ID D7T1ePGNOOs
InChI InChI=1S/C19H32O2.H2O/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;/h12-17,20-21H,3-11H2,1-2H3;1H2/t12-,13-,14-,15-,16-,17-,18-,19-;/m0./s1
InChIKey IOIXDBPGNHNGOY-JXZLFAAWSA-N
Mol Weight 308.5 g/mol
Molecular Formula C19H32O3
Exact Mass 308.235145 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Pq1RjBkI8d
Name 5α-androstane-3β,17β-diol, hydrate
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number 85093-4
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H34O3
InChI InChI=1S/C19H32O2.H2O/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;/h12-17,20-21H,3-11H2,1-2H3;1H2/t12-,13-,14-,15-,16-,17-,18-,19-;/m0./s1
InChIKey IOIXDBPGNHNGOY-JXZLFAAWSA-N
Melting Point 165-167C
Molecular Weight 310.477997
Synonyms 5A-ANDROSTANE-3B,17B-DIOL, HYDRATE
Technique KBr WAFER