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5a-Cholestane-3b,5,6b-triol 3,6-diacetate

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

5a-Cholestane-3b,5,6b-triol 3,6-diacetate
SpectraBase Compound ID 3jXkgUCCGP0
InChI InChI=1S/C31H52O5/c1-19(2)9-8-10-20(3)25-11-12-26-24-17-28(36-22(5)33)31(34)18-23(35-21(4)32)13-16-30(31,7)27(24)14-15-29(25,26)6/h19-20,23-28,34H,8-18H2,1-7H3/t20-,23+,24+,25-,26+,27+,28-,29-,30-,31+/m1/s1
InChIKey FSOSLUNLZBKXMA-ZJBXHLDWSA-N
Mol Weight 504.8 g/mol
Molecular Formula C31H52O5
Exact Mass 504.381475 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3MYKeMa4Z6c
Name 5α-cholestane-3β,5,6β-triol, 3,6-diacetate
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S63751
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H52O5
InChI InChI=1S/C31H52O5/c1-19(2)9-8-10-20(3)25-11-12-26-24-17-28(36-22(5)33)31(34)18-23(35-21(4)32)13-16-30(31,7)27(24)14-15-29(25,26)6/h19-20,23-28,34H,8-18H2,1-7H3/t20-,23+,24+,25-,26+,27+,28-,29-,30-,31+/m1/s1
InChIKey FSOSLUNLZBKXMA-ZJBXHLDWSA-N
Molecular Weight 504.752014
Synonyms 5A-CHOLESTANE-3B,5,6B-TRIOL, 3,6-DI- ACETATE
Technique KBr WAFER