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2a-Bromo-cholest-5-en-3-one

View entire compound with spectra: 2 NMR

2a-Bromo-cholest-5-en-3-one
SpectraBase Compound ID 62znYg80LL9
InChI InChI=1S/C27H43BrO/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-25(29)24(28)16-27(19,5)23(20)13-14-26(21,22)4/h9,17-18,20-24H,6-8,10-16H2,1-5H3
InChIKey SCYJTQAIJDMROP-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 88jYj4usDPL
Name 2a-Bromo-cholest-5-en-3-one
CAS Registry Number 91509-57-8
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)21-11-12-22-20-10-9-19-15-25(29)24(28)16-27(19,5)23(20)13-14-26(21,22)4/h9,17-18,20-24H,6-8,10-16H2,1-5H3
InChIKey SCYJTQAIJDMROP-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference J. Roemer, D. Scheller, G. Grossmann, J. Prakt. Chem. 326, 273 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3