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3β-bromocholest-5-ene

View entire compound with spectra: 2 NMR

3β-bromocholest-5-ene
SpectraBase Compound ID C7lRfKzoYys
InChI InChI=1S/C27H45Br/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/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey WDRGNJZPWVRVSN-DPAQBDIFSA-N
Mol Weight 449.6 g/mol
Molecular Formula C27H45Br
Exact Mass 448.270464 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 16fYEaVFAxQ
Name 3β-bromocholest-5-ene
Source of Sample Eastman Organic Chemicals, Rochester, New York
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H45Br
InChI InChI=1S/C27H45Br/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/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey WDRGNJZPWVRVSN-DPAQBDIFSA-N
Melting Point 98C
Molecular Weight 449.57
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CHOLEST-5-ENE, 3B-BROMO-,