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3-BETA-CHLOROCHOLEST-5-ENE;CHOLESTERYL-CHLORIDE
SpectraBase Compound ID 8eGANAnPSjh
InChI InChI=1S/C27H45Cl/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19?,21-,22?,23+,24?,25?,26-,27+/m0/s1
InChIKey OTVRYZXVVMZHHW-RJLWFLQPSA-N
Mol Weight 405.1 g/mol
Molecular Formula C27H45Cl
Exact Mass 404.320979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9bR0M3kXnYW
Name 3-BETA-CHLOROCHOLEST-5-ENE;CHOLESTERYL-CHLORIDE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45Cl
InChI InChI=1S/C27H45Cl/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19?,21-,22?,23+,24?,25?,26-,27+/m0/s1
InChIKey OTVRYZXVVMZHHW-RJLWFLQPSA-N
Literature Reference Author H.J.BUCHANAN,P.J.COX,S.M.S.V.DOIDGE-HARRISON,R.A.HOWIE,M.JAS PARS,J.L.WARDELL
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3657(1997)
Literature Reference DOI 10.1039/a703596i
Molecular Weight 405.107 g/mol
Solvent CDCl3