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2b-Bromo-3a-cholestanol

View entire compound with spectra: 5 NMR

2b-Bromo-3a-cholestanol
SpectraBase Compound ID 7w0MGSKhavF
InChI InChI=1S/C27H47BrO/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/h17-25,29H,6-16H2,1-5H3
InChIKey IZWHBFBYKQEQAB-UHFFFAOYSA-N
Mol Weight 467.6 g/mol
Molecular Formula C27H47BrO
Exact Mass 466.281029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JKK5gXdthsR
Name 2a-Bromo-5a-cholestan-3b-ol
CAS Registry Number 3903-52-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H47BrO
InChI InChI=1S/C27H47BrO/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/h17-25,29H,6-16H2,1-5H3
InChIKey IZWHBFBYKQEQAB-UHFFFAOYSA-N
Literature Reference J.W. Blunt, J.B. Stothers, Org. Magn. Resonance 9, 439 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3