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12-ALPHA-ACETOXY-5-BETA-CHOLSAEUREMETHYLESTER

View entire compound with spectra: 1 NMR

12-ALPHA-ACETOXY-5-BETA-CHOLSAEUREMETHYLESTER
SpectraBase Compound ID FkDyLDWGd01
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/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1
InChIKey QSVNTGGTUZYSIF-XVYZBDJZSA-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 6Rbj5VSndCM
Name 12-ALPHA-ACETOXY-5-BETA-CHOLSAEUREMETHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1
InChIKey QSVNTGGTUZYSIF-XVYZBDJZSA-N
Literature Reference Author T.IIDA,T.TAMURA,T.MATSUMOTO,F.C.CHANG
Literature Reference Citation ORG.MAGN.RES.,21,305(1983)
Literature Reference DOI 10.1002/omr.1270210504
Molecular Weight 432.644 g/mol
Solvent CDCl3
Source File Reference UNIW6449