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3,5-DIMETHYL-4-TRIFLUOROMETHYL-1,2-DIHYDRO-2-THIOPYRIMIDINONE
SpectraBase Compound ID 4owCp2Uv8Yz
InChI InChI=1S/C7H7F3N2S/c1-4-3-11-6(13)12(2)5(4)7(8,9)10/h3H,1-2H3
InChIKey IJRSTTOJHHHMSW-UHFFFAOYSA-N
Mol Weight 208.2 g/mol
Molecular Formula C7H7F3N2S
Exact Mass 208.028204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HfPrfR0zo2w
Name 3,5-DIMETHYL-4-TRIFLUOROMETHYL-1,2-DIHYDRO-2-THIOPYRIMIDINONE
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7F3N2S
InChI InChI=1S/C7H7F3N2S/c1-4-3-11-6(13)12(2)5(4)7(8,9)10/h3H,1-2H3
InChIKey IJRSTTOJHHHMSW-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 208.201 g/mol
Solvent DMSO-D6
Source File Reference UWSI24710