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4-TRICHLOROMETHYL-5-METHYL-PYRIMIDIN-2-ONE
SpectraBase Compound ID JwUaZH5CxmU
InChI InChI=1S/C6H5Cl3N2O/c1-3-2-10-5(12)11-4(3)6(7,8)9/h2H,1H3,(H,10,11,12)
InChIKey FPTYFTKCGLGUDL-UHFFFAOYSA-N
Mol Weight 227.48 g/mol
Molecular Formula C6H5Cl3N2O
Exact Mass 225.946746 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GX0hO3wvILh
Name 4-TRICHLOROMETHYL-5-METHYL-PYRIMIDIN-2-ONE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H5Cl3N2O
InChI InChI=1S/C6H5Cl3N2O/c1-3-2-10-5(12)11-4(3)6(7,8)9/h2H,1H3,(H,10,11,12)
InChIKey FPTYFTKCGLGUDL-UHFFFAOYSA-N
Literature Reference Author I.L.PACHOLSKI,I.BLANCO,N.ZANATTA,M.A.P.MARTINS
Literature Reference Citation J.BRAZ.CHEM.SOC.,2,118(1991)
Literature Reference DOI 10.5935/0103-5053.19910025
Molecular Weight 227.477 g/mol
Solvent DMSO-D6
Source File Reference UWLU5613