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4-imino-3-(2-methoxyethyl)-1,2,3,4-tetrahydro-2-thioxo-5-pyrimidinecarboxylic acid, ethyl ester
SpectraBase Compound ID E054U7znTtu
InChI InChI=1S/C10H15N3O3S/c1-3-16-9(14)7-6-12-10(17)13(8(7)11)4-5-15-2/h6,11H,3-5H2,1-2H3,(H,12,17)
InChIKey GPBJJUMOMHURMG-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C10H15N3O3S
Exact Mass 257.083413 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3TP8Xilm13c
Name 4-imino-3-(2-methoxyethyl)-1,2,3,4-tetrahydro-2-thioxo-5-pyrimidinecarboxylic acid, ethyl ester
Source of Sample C. Whitehead, the Lilly Research Laboratories, Indianapolis, Indiana
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Formula C10H15N3O3S
InChI InChI=1S/C10H15N3O3S/c1-3-16-9(14)7-6-12-10(17)13(8(7)11)4-5-15-2/h6,11H,3-5H2,1-2H3,(H,12,17)
InChIKey GPBJJUMOMHURMG-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 1797M
Solvent TFA
Synonyms 5-PYRIMIDINECARBOXYLIC ACID, 4-IMINO- 3-/2-METHOXYETHYL/-1,2,3,4-TETRAHYDRO- 2-THIOXO-, ETHYL ESTER