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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4UgSY6Nqm8D
Name DE-A,B-8-ETHYNYL-CHOLEST-8(14)-ENE;(VITAMIN-D-DERIVATIVE)
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32
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
Literature Reference Author C.A.HOEGER,A.D.JOHNSTON,W.H.OKAMURA
Literature Reference Citation J.AM.CHEM.SOC.,109,4690(1987)
Literature Reference DOI 10.1021/ja00249a035
Molecular Weight 272.474 g/mol
Solvent CDCl3
Source File Reference UWWR5050