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4,6b-Dibromo-cholest-4-en-3-one

View entire compound with spectra: 1 NMR

4,6b-Dibromo-cholest-4-en-3-one
SpectraBase Compound ID 7NLIvVgeJts
InChI InChI=1S/C27H42Br2O/c1-16(2)7-6-8-17(3)19-9-10-20-18-15-22(28)24-25(29)23(30)12-14-27(24,5)21(18)11-13-26(19,20)4/h16-22H,6-15H2,1-5H3
InChIKey RGFBRXLXXFVFDI-UHFFFAOYSA-N
Mol Weight 542.4 g/mol
Molecular Formula C27H42Br2O
Exact Mass 540.160242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AcPKZiHvUE6
Name 4,6b-Dibromo-cholest-4-en-3-one
CAS Registry Number 3702-39-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H42Br2O
InChI InChI=1S/C27H42Br2O/c1-16(2)7-6-8-17(3)19-9-10-20-18-15-22(28)24-25(29)23(30)12-14-27(24,5)21(18)11-13-26(19,20)4/h16-22H,6-15H2,1-5H3
InChIKey RGFBRXLXXFVFDI-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