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(TRANS)-3-BROMO-CYCLOHEXANOL;CONFORMER-2AE
SpectraBase Compound ID BCVR51ks4Jo
InChI InChI=1S/C6H11BrO/c7-5-2-1-3-6(8)4-5/h5-6,8H,1-4H2/t5-,6-/m1/s1
InChIKey CXYNOIDYMJDBLS-PHDIDXHHSA-N
Mol Weight 179.06 g/mol
Molecular Formula C6H11BrO
Exact Mass 177.999328 g/mol
Enantiomer InChIKey CXYNOIDYMJDBLS-WDSKDSINSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CS2:CD2Cl2=9:1
Title Journal or Book Year
Conformational equilibria oftrans -3-X-cyclohexanols (X = Cl, Br, CH3 and OCH3). A low temperature NMR study and theoretical calculations Magnetic Resonance in Chemistry 2008

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