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7-ALPHA-ACETOXY-5-BETA-CHOLSAEUREMETHYLESTER

View entire compound with spectra: 1 NMR

7-ALPHA-ACETOXY-5-BETA-CHOLSAEUREMETHYLESTER
SpectraBase Compound ID He8p7jz8I0Y
InChI InChI=1S/C27H44O4/c1-17(9-12-24(29)30-5)20-10-11-21-25-22(13-15-27(20,21)4)26(3)14-7-6-8-19(26)16-23(25)31-18(2)28/h17,19-23,25H,6-16H2,1-5H3/t17-,19+,20-,21+,22+,23-,25+,26+,27-/m1/s1
InChIKey MEQHSXBFVVGRAG-HDZKEMKGSA-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 CQFyEvNe6Xk
Name 7-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(9-12-24(29)30-5)20-10-11-21-25-22(13-15-27(20,21)4)26(3)14-7-6-8-19(26)16-23(25)31-18(2)28/h17,19-23,25H,6-16H2,1-5H3/t17-,19+,20-,21+,22+,23-,25+,26+,27-/m1/s1
InChIKey MEQHSXBFVVGRAG-HDZKEMKGSA-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 UNIW6448