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METHYL_N'-[3-BROMO-2-(2,3-DIBROMO-4,5-DIHYDROXYBENZYL)-4,5-DIHYDROXYBENZYL]-GAMMA-UREIDOBUTYRATE
SpectraBase Compound ID 1zNjtbG0I7J
InChI InChI=1S/C20H21Br3N2O7/c1-32-14(28)3-2-4-24-20(31)25-8-10-7-13(27)18(29)16(22)11(10)5-9-6-12(26)19(30)17(23)15(9)21/h6-7,26-27,29-30H,2-5,8H2,1H3,(H2,24,25,31)
InChIKey MEVCZGFMVBBZMZ-UHFFFAOYSA-N
Mol Weight 641.11 g/mol
Molecular Formula C20H21Br3N2O7
Exact Mass 637.88989 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DnJReQPe8wh
Name METHYL_N'-[3-BROMO-2-(2,3-DIBROMO-4,5-DIHYDROXYBENZYL)-4,5-DIHYDROXYBENZYL]-GAMMA-UREIDOBUTYRATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21Br3N2O7
InChI InChI=1S/C20H21Br3N2O7/c1-32-14(28)3-2-4-24-20(31)25-8-10-7-13(27)18(29)16(22)11(10)5-9-6-12(26)19(30)17(23)15(9)21/h6-7,26-27,29-30H,2-5,8H2,1H3,(H2,24,25,31)
InChIKey MEVCZGFMVBBZMZ-UHFFFAOYSA-N
Literature Reference Author M.MA,J.ZHAO,S.WANG,S.LI,Y.YANG,J.SHI,X.FAN,L.HE
Literature Reference Citation J.NAT.PROD.,69,206(2006)
Literature Reference DOI 10.1021/np050343g
Molecular Weight 641.108 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ18060