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4-[(3-BENZYL-5-METHYL-2,6-DIOXO-1,2,3,6-TETRAHYDROPYRIMIDIN-1-YL)-METHYL]-ISOXAZOLE-3-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID CJEL9rdAstQ
InChI InChI=1S/C19H19N3O5/c1-3-26-18(24)16-15(12-27-20-16)11-22-17(23)13(2)9-21(19(22)25)10-14-7-5-4-6-8-14/h4-9,12H,3,10-11H2,1-2H3
InChIKey YNDVZQCLJLYUJJ-UHFFFAOYSA-N
Mol Weight 369.38 g/mol
Molecular Formula C19H19N3O5
Exact Mass 369.132471 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8eXxyhqQfmJ
Name 4-[(3-BENZYL-5-METHYL-2,6-DIOXO-1,2,3,6-TETRAHYDROPYRIMIDIN-1-YL)-METHYL]-ISOXAZOLE-3-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H19N3O5
InChI InChI=1S/C19H19N3O5/c1-3-26-18(24)16-15(12-27-20-16)11-22-17(23)13(2)9-21(19(22)25)10-14-7-5-4-6-8-14/h4-9,12H,3,10-11H2,1-2H3
InChIKey YNDVZQCLJLYUJJ-UHFFFAOYSA-N
Literature Reference Author C.PEREZ,Y.L.JANIN,D.R.ADAMS,C.MONNERET,D.S.GRIERSON
Literature Reference Citation J.CHEM.SOC.PERKIN-1,901(1997)
Literature Reference DOI 10.1039/a605995c
Molecular Weight 369.377 g/mol
Solvent CDCl3
Source File Reference UWRU11213