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6-CHLOROMERCURICHOLEST-5-EN-3-BETA-OL

View entire compound with spectra: 1 NMR

6-CHLOROMERCURICHOLEST-5-EN-3-BETA-OL
SpectraBase Compound ID 1r7Jv3i4aUn
InChI InChI=1S/C27H45O.ClH.Hg/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;;/h18-19,21-25,28H,6-8,10-17H2,1-5H3;1H;/q;;+1/p-1/t19-,21+,22+,23-,24+,25+,26+,27-;;/m1../s1
InChIKey YUDIFUJJWICWMY-RTFZCPRASA-M
Mol Weight 621.7 g/mol
Molecular Formula C27H45ClHgO
Exact Mass 622.286538 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K7mXrulP5rc
Name 6-CHLOROMERCURICHOLEST-5-EN-3-BETA-OL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45ClHgO
InChI InChI=1S/C27H45O.ClH.Hg/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;;/h18-19,21-25,28H,6-8,10-17H2,1-5H3;1H;/q;;+1/p-1/t19-,21+,22+,23-,24+,25+,26+,27-;;/m1../s1
InChIKey YUDIFUJJWICWMY-RTFZCPRASA-M
Literature Reference Author R.J.FLANAGAN,F.P.CHARLESON,E.I.SYNNES,L.I.WIEBE,Y.X.THERIAUL T,T.T.NAKASHIMA
Literature Reference Citation CAN.J.CHEM.,63,2853(1985)
Literature Reference DOI 10.1139/v85-476
Molecular Weight 621.697 g/mol
Solvent CDCl3
Source File Reference UWED1056