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12a-Acetoxy-5b-cholanic acid, methyl ester

View entire compound with spectra: 1 NMR

12a-Acetoxy-5b-cholanic acid, methyl ester
SpectraBase Compound ID H4Q3agiTIwa
InChI InChI=1S/C27H44O4/c1-17(9-14-25(29)30-5)21-12-13-22-20-11-10-19-8-6-7-15-26(19,3)23(20)16-24(27(21,22)4)31-18(2)28/h17,19-24H,6-16H2,1-5H3
InChIKey QSVNTGGTUZYSIF-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H44O4
Exact Mass 432.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EvFS8e5WHmJ
Name 12a-Acetoxy-5b-cholanic acid, methyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-17(9-14-25(29)30-5)21-12-13-22-20-11-10-19-8-6-7-15-26(19,3)23(20)16-24(27(21,22)4)31-18(2)28/h17,19-24H,6-16H2,1-5H3
InChIKey QSVNTGGTUZYSIF-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference T. Iida, T. Tamura, T. Matsumoto, Org. Magn. Resonance 21, 305 (1983).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3