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1-HYDROXY-3,4,5,6,2',4'-HEXABROMODIPHENYLETHER
SpectraBase Compound ID 3ZbX0JtA9I9
InChI InChI=1S/C12H4Br6O2/c13-4-1-2-6(5(14)3-4)20-12-10(18)8(16)7(15)9(17)11(12)19/h1-3,19H
InChIKey LDMKXEGTHGJWLG-UHFFFAOYSA-N
Mol Weight 659.59 g/mol
Molecular Formula C12H4Br6O2
Exact Mass 653.531157 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JuFj5IGNjyK
Name 1-HYDROXY-3,4,5,6,2',4'-HEXABROMODIPHENYLETHER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H4Br6O2
InChI InChI=1S/C12H4Br6O2/c13-4-1-2-6(5(14)3-4)20-12-10(18)8(16)7(15)9(17)11(12)19/h1-3,19H
InChIKey LDMKXEGTHGJWLG-UHFFFAOYSA-N
Literature Reference Author M.S.AGRAWAL,B.F.BOWDEN
Literature Reference Citation MAR.DRUGS,3,9(2005)
Literature Reference DOI 10.3390/md301009
Molecular Weight 659.587 g/mol
Sample ID 46424
Solvent CDCl3