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3-benzyl-4-imino-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylic acid, ethyl ester
SpectraBase Compound ID 2Su7yO6wLVQ
InChI InChI=1S/C14H15N3O3/c1-2-20-13(18)11-8-16-14(19)17(12(11)15)9-10-6-4-3-5-7-10/h3-8,15H,2,9H2,1H3,(H,16,19)
InChIKey CMCLHIUHKZOWTF-UHFFFAOYSA-N
Mol Weight 273.29 g/mol
Molecular Formula C14H15N3O3
Exact Mass 273.111341 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D3gIk85W80A
Name 3-benzyl-4-imino-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylic acid, ethyl ester
Source of Sample C. Whitehead, the Lilly Research Laboratories, Indianapolis, Indiana
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Formula C14H15N3O3
InChI InChI=1S/C14H15N3O3/c1-2-20-13(18)11-8-16-14(19)17(12(11)15)9-10-6-4-3-5-7-10/h3-8,15H,2,9H2,1H3,(H,16,19)
InChIKey CMCLHIUHKZOWTF-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 1803M
Solvent TFA
Synonyms 5-PYRIMIDINECARBOXYLIC ACID, 3-BENZYL-4-IMINO-2-OXO-1,2,3,4-TETRA- HYDRO-, ETHYL ESTER