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4-(2-chloro-6-fluorophenyl)-6-methyl-1,2,3,4-tetrahydro-2-thioxo-5-pyrimidinecarboxylic acid, ethyl ester
SpectraBase Compound ID G8AC4CtVShu
InChI InChI=1S/C14H14ClFN2O2S/c1-3-20-13(19)10-7(2)17-14(21)18-12(10)11-8(15)5-4-6-9(11)16/h4-6,12H,3H2,1-2H3,(H2,17,18,21)
InChIKey DZSLWIFPPHLIRK-UHFFFAOYSA-N
Mol Weight 328.79 g/mol
Molecular Formula C14H14ClFN2O2S
Exact Mass 328.044855 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SIEsqTcTLr
Name 4-(2-chloro-6-fluorophenyl)-6-methyl-1,2,3,4-tetrahydro-2-thioxo-5-pyrimidinecarboxylic acid, ethyl ester
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Formula C14H14ClFN2O2S
InChI InChI=1S/C14H14ClFN2O2S/c1-3-20-13(19)10-7(2)17-14(21)18-12(10)11-8(15)5-4-6-9(11)16/h4-6,12H,3H2,1-2H3,(H2,17,18,21)
InChIKey DZSLWIFPPHLIRK-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 48056M
Solvent DMSO-d6