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DE-A,B-8-ETHYNYL-CHOLEST-8(14)-ENE;(VITAMIN-D-DERIVATIVE)
SpectraBase Compound ID 9Jq4U6GX0m1
InChI InChI=1S/C20H32/c1-6-17-11-8-14-20(5)18(12-13-19(17)20)16(4)10-7-9-15(2)3/h1,15-16,18H,7-14H2,2-5H3/t16-,18-,20-/m1/s1
InChIKey YAFDSZJUAGARPQ-YVWKXTFCSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol
Enantiomer InChIKey YAFDSZJUAGARPQ-QRFRQXIXSA-N
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Studies of vitamin D (calciferol) and its analogs. 30. Thermal [1,7]-sigmatropic hydrogen shifts: stereochemistry, kinetics, isotope effects and .pi.-facial selectivity Journal of the American Chemical Society 1987

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