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1-METHYL-4-TRIFLUOROMETHYL-1,2-DIHYDRO-2-PYRIMIDINETHIONE
SpectraBase Compound ID 9N5QN9qnTUA
InChI InChI=1S/C6H5F3N2S/c1-11-3-2-4(6(7,8)9)10-5(11)12/h2-3H,1H3
InChIKey AZAHQYDPLNNNSX-UHFFFAOYSA-N
Mol Weight 194.18 g/mol
Molecular Formula C6H5F3N2S
Exact Mass 194.012554 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6O8rW1XM67
Name 1-METHYL-4-TRIFLUOROMETHYL-1,2-DIHYDRO-2-PYRIMIDINETHIONE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H5F3N2S
InChI InChI=1S/C6H5F3N2S/c1-11-3-2-4(6(7,8)9)10-5(11)12/h2-3H,1H3
InChIKey AZAHQYDPLNNNSX-UHFFFAOYSA-N
Literature Reference Author N.ZANATTA,C.D.C.MADRUGA,P.D.C.MARISCO,D.C.FLORES,H.G.BONACOR SO,M.A.P.MARTINS
Literature Reference Citation J.HETCYCL.CHEM.,37,1213(2000)
Literature Reference DOI 10.1002/jhet.5570370531
Molecular Weight 194.174 g/mol
Solvent DMSO-D6
Source File Reference UWSI24707