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FUZVJQBFHDTDIO-UHFFFAOYSA-N
SpectraBase Compound ID 2fUGOWJg4sy
InChI InChI=1S/C16H13Br3O6/c1-25-15-9(17)3-6(4-11(15)21)8(16(23)24)2-7-5-10(20)14(22)13(19)12(7)18/h3-5,8,20-22H,2H2,1H3,(H,23,24)
InChIKey FUZVJQBFHDTDIO-UHFFFAOYSA-N
Mol Weight 540.99 g/mol
Molecular Formula C16H13Br3O6
Exact Mass 537.826227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IIqg8vMCgaD
Name 2-(3-BrOMO-5-HYDROXY-4-METHOXYPHENYL)-3-(2,3-DIBrOMO-4,5-DIHYDROXYPHENYL)-PROPIONIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13Br3O6
InChI InChI=1S/C16H13Br3O6/c1-25-15-9(17)3-6(4-11(15)21)8(16(23)24)2-7-5-10(20)14(22)13(19)12(7)18/h3-5,8,20-22H,2H2,1H3,(H,23,24)
InChIKey FUZVJQBFHDTDIO-UHFFFAOYSA-N
Literature Reference Author J.ZHAO,X.FAN,S.WANG,S.LI,S.SHANG,Y.YANG,N.XU,Y.LUE,J.SHI
Literature Reference Citation J.NAT.PROD.,67,1032(2004)
Literature Reference DOI 10.1021/np030546+
Molecular Weight 540.988 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ7253