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CGWFVWNCURPETC-UHFFFAOYSA-N
SpectraBase Compound ID En0ZWsRIe6v
InChI InChI=1S/C17H15Br3O6/c1-25-16-10(18)4-7(5-12(16)22)9(17(24)26-2)3-8-6-11(21)15(23)14(20)13(8)19/h4-6,9,21-23H,3H2,1-2H3
InChIKey CGWFVWNCURPETC-UHFFFAOYSA-N
Mol Weight 555.01 g/mol
Molecular Formula C17H15Br3O6
Exact Mass 551.841877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IottGX50Ynt
Name 2-(3-BrOMO-5-HYDROXY-4-METHOXYPHENYL)-3-(2,3-DIBrOMO-4,5-DIHYDROXYPHENYL)-PROPIONIC_ACID_METHYLESTER
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15Br3O6
InChI InChI=1S/C17H15Br3O6/c1-25-16-10(18)4-7(5-12(16)22)9(17(24)26-2)3-8-6-11(21)15(23)14(20)13(8)19/h4-6,9,21-23H,3H2,1-2H3
InChIKey CGWFVWNCURPETC-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 555.015 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ7254