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2-PHENYL-3-(2,3-DIBrOMO-4,5-DIHYDROXYPHENYL)-PROPIONIC_ACID
SpectraBase Compound ID Av1qRixKQjL
InChI InChI=1S/C15H12Br2O4/c16-12-9(7-11(18)14(19)13(12)17)6-10(15(20)21)8-4-2-1-3-5-8/h1-5,7,10,18-19H,6H2,(H,20,21)
InChIKey XUABTOLUYWZDOY-UHFFFAOYSA-N
Mol Weight 416.07 g/mol
Molecular Formula C15H12Br2O4
Exact Mass 413.910235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26306NWeBCD
Name 2-PHENYL-3-(2,3-DIBrOMO-4,5-DIHYDROXYPHENYL)-PROPIONIC_ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H12Br2O4
InChI InChI=1S/C15H12Br2O4/c16-12-9(7-11(18)14(19)13(12)17)6-10(15(20)21)8-4-2-1-3-5-8/h1-5,7,10,18-19H,6H2,(H,20,21)
InChIKey XUABTOLUYWZDOY-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 416.066 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ7255