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6b-Bromo-cholest-4-en-3-one

View entire compound with spectra: 1 NMR

6b-Bromo-cholest-4-en-3-one
SpectraBase Compound ID 3u6IXtD043u
InChI InChI=1S/C27H43BrO/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(28)24-15-19(29)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-18,20-23,25H,6-14,16H2,1-5H3
InChIKey SMYHXVUYHYXRCN-UHFFFAOYSA-N
Mol Weight 463.5 g/mol
Molecular Formula C27H43BrO
Exact Mass 462.249729 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JkgINBeqUvL
Name 6b-Bromo-cholest-4-en-3-one
CAS Registry Number 3464-61-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H43BrO
InChI InChI=1S/C27H43BrO/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(28)24-15-19(29)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-18,20-23,25H,6-14,16H2,1-5H3
InChIKey SMYHXVUYHYXRCN-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference J. Roemer, D. Scheller, G. Grossmann, J. Prakt. Chem. 327, 169, (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3