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METHYL-N'-(2,3,6-TRIBROMO-4,5-DIHYDROXYBENZYL)-GAMMA-UREIDOBUTYRATE
SpectraBase Compound ID 6zxHSZyLEjz
InChI InChI=1S/C13H15Br3N2O5/c1-23-7(19)3-2-4-17-13(22)18-5-6-8(14)10(16)12(21)11(20)9(6)15/h20-21H,2-5H2,1H3,(H2,17,18,22)
InChIKey IGOSCDDMXAXDHQ-UHFFFAOYSA-N
Mol Weight 518.98 g/mol
Molecular Formula C13H15Br3N2O5
Exact Mass 515.853111 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4bwym5gZIOh
Name METHYL-N'-(2,3,6-TRIBROMO-4,5-DIHYDROXYBENZYL)-GAMMA-UREIDOBUTYRATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15Br3N2O5
InChI InChI=1S/C13H15Br3N2O5/c1-23-7(19)3-2-4-17-13(22)18-5-6-8(14)10(16)12(21)11(20)9(6)15/h20-21H,2-5H2,1H3,(H2,17,18,22)
InChIKey IGOSCDDMXAXDHQ-UHFFFAOYSA-N
Literature Reference Author X.XU,L.YIN,L.GAO,J.CHEN,J.LI,F.SONG
Literature Reference Citation MAR.DRUGS,11,842(2013)
Literature Reference DOI 10.3390/md11030842
Molecular Weight 518.985 g/mol
Source File Reference UWLU74794