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6-AMINO-3-BUTYL-5-(4-CARBOXYMETHYLOXYBENZYLIDEN)-AMINOURACIL
SpectraBase Compound ID EkxT7wzW5Kx
InChI InChI=1S/C17H20N4O5/c1-2-3-8-21-16(24)14(15(18)20-17(21)25)19-9-11-4-6-12(7-5-11)26-10-13(22)23/h4-7,9H,2-3,8,10,18H2,1H3,(H,20,25)(H,22,23)/b19-9+
InChIKey NHFICEXNYVUXEW-DJKKODMXSA-N
Mol Weight 360.37 g/mol
Molecular Formula C17H20N4O5
Exact Mass 360.14337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JGhK95xwL9r
Name 6-AMINO-3-BUTYL-5-(4-CARBOXYMETHYLOXYBENZYLIDEN)-AMINOURACIL
Compound Number 4BE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20N4O5
InChI InChI=1S/C17H20N4O5/c1-2-3-8-21-16(24)14(15(18)20-17(21)25)19-9-11-4-6-12(7-5-11)26-10-13(22)23/h4-7,9H,2-3,8,10,18H2,1H3,(H,20,25)(H,22,23)/b19-9+
InChIKey NHFICEXNYVUXEW-DJKKODMXSA-N
Literature Reference Author A.M.HAYALLAH,J.SANDOVAL-RAMIREZ,U.REITH,U.SCHOBERT,B.PREISS, B.SCHUMACHER,J.W.DAL
Literature Reference Citation J.MED.CHEM.,45,1500(2002)
Literature Reference DOI 10.1021/jm011049y
Molecular Weight 360.370 g/mol
Sample ID 64296
Solvent DMSO-D6