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5-ALPHA,8-ALPHA-(METHYLEN)-3-BETA-ACETOXY-CHOLEST-6-ONE
SpectraBase Compound ID AFjaYz4zydv
InChI InChI=1S/C30H48O3/c1-19(2)8-7-9-20(3)23-10-11-24-27(23,5)14-13-25-28(6)15-12-22(33-21(4)31)16-30(28)18-29(24,25)17-26(30)32/h19-20,22-25H,7-18H2,1-6H3/t20-,22+,23-,24-,25-,27-,28-,29+,30+/m1/s1
InChIKey HWBJLJLQUIGPMU-PSFGFNDYSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID stSnrSVhP9
Name 5-ALPHA,8-ALPHA-(METHYLEN)-3-BETA-ACETOXY-CHOLEST-6-ONE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-19(2)8-7-9-20(3)23-10-11-24-27(23,5)14-13-25-28(6)15-12-22(33-21(4)31)16-30(28)18-29(24,25)17-26(30)32/h19-20,22-25H,7-18H2,1-6H3/t20-,22+,23-,24-,25-,27-,28-,29+,30+/m1/s1
InChIKey HWBJLJLQUIGPMU-PSFGFNDYSA-N
Literature Reference Author F.M.WINNIK,P.YATES
Literature Reference Citation MAGN.RES.CHEM.,23,822(1985)
Literature Reference DOI 10.1002/mrc.1260231007
Molecular Weight 456.709 g/mol
Solvent CDCl3
Source File Reference UNIW20452