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3α-hydroxy-12-oxochol-9(11)-en-24-oic acid

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

3α-hydroxy-12-oxochol-9(11)-en-24-oic acid
SpectraBase Compound ID 31GuxMcK4IW
InChI InChI=1S/C24H36O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h13-19,25H,4-12H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,23+,24-/m1/s1
InChIKey RMEZJKHOZLUOHB-OZEXFWQTSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6T3HnwzgS6P
Name 3α-hydroxy-12-oxochol-9(11)-en-24-oic acid
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S63715
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h13-19,25H,4-12H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,23+,24-/m1/s1
InChIKey RMEZJKHOZLUOHB-OZEXFWQTSA-N
Molecular Weight 388.548004
Synonyms CHOL-9/11/-EN-24-OIC ACID, 3A-HYDROXY-12-OXO-,
Technique KBr WAFER