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5a,6b-Dibromo-cholestan-3-one

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5a,6b-Dibromo-cholestan-3-one
SpectraBase Compound ID Kq6IUuqQinA
InChI InChI=1S/C27H44Br2O/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(28)27(29)16-19(30)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-18,20-24H,6-16H2,1-5H3/t18-,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1
InChIKey RMQXJLCPVCCLRY-HTTNMUSBSA-N
Mol Weight 544.5 g/mol
Molecular Formula C27H44Br2O
Exact Mass 542.175892 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B7OMtFLVgUf
Name 5-ALPHA,6-BETA-DIBROMO-CHOLESTAN-3-ONE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44Br2O
InChI InChI=1S/C27H44Br2O/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(28)27(29)16-19(30)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-18,20-24H,6-16H2,1-5H3/t18-,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1
InChIKey RMQXJLCPVCCLRY-HTTNMUSBSA-N
Literature Reference Author J.ROMER,S.SCHELLER,G.GROSSMANN
Literature Reference Citation J.PRAKT.CHEM.,326,273(1984)
Literature Reference DOI 10.1002/prac.19843260212
Molecular Weight 544.454 g/mol
Solvent Unknown
Source File Reference UWCS11176