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2-(2',4'-DIBROMOPHENOXY)-3,5-DIBROMO-4-METHOXYPHENOL
SpectraBase Compound ID 2PRx2TXbMML
InChI InChI=1S/C13H8Br4O3/c1-19-12-8(16)5-9(18)13(11(12)17)20-10-3-2-6(14)4-7(10)15/h2-5,18H,1H3
InChIKey QBTZMUYKCJKJQV-UHFFFAOYSA-N
Mol Weight 531.82 g/mol
Molecular Formula C13H8Br4O3
Exact Mass 527.720696 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EeNyrZD9jpy
Name 2-(2',4'-DIBROMOPHENOXY)-3,5-DIBROMO-4-METHOXYPHENOL
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H8Br4O3
InChI InChI=1S/C13H8Br4O3/c1-19-12-8(16)5-9(18)13(11(12)17)20-10-3-2-6(14)4-7(10)15/h2-5,18H,1H3
InChIKey QBTZMUYKCJKJQV-UHFFFAOYSA-N
Literature Reference Author L.CALCUL,R.CHOW,A.G.OLIVER,K.TENNEY,K.N.WHITE,A.W.WOOD,C.FIO RILLA,P.CREWS
Literature Reference Citation J.NAT.PROD.,72,443(2009)
Literature Reference DOI 10.1021/np800737z
Molecular Weight 531.821 g/mol
Sample ID 32278
Solvent CDCl3