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6-(DIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYL)-2-TIOXO-2,3-DIHYDROPYRIMIDIN-4-ONE
SpectraBase Compound ID 8fR8EHBu0Pt
InChI InChI=1S/C17H11F3N2OS/c18-12-6-8-13(9-7-12)22-15(23)10-14(21-16(22)24)17(19,20)11-4-2-1-3-5-11/h1-10H,(H,21,24)
InChIKey HTJAJFLPAOCJDW-UHFFFAOYSA-N
Mol Weight 348.34 g/mol
Molecular Formula C17H11F3N2OS
Exact Mass 348.054419 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KJtiEiP8SEf
Name 6-(DIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYL)-2-TIOXO-2,3-DIHYDROPYRIMIDIN-4-ONE
Compound Number 5J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H11F3N2OS
InChI InChI=1S/C17H11F3N2OS/c18-12-6-8-13(9-7-12)22-15(23)10-14(21-16(22)24)17(19,20)11-4-2-1-3-5-11/h1-10H,(H,21,24)
InChIKey HTJAJFLPAOCJDW-UHFFFAOYSA-N
Literature Reference Author S.FUSTERO,J.PIERA,J.F.SANZ-CERVERA,S.CATALAN,C.R.D.ARELLANO
Literature Reference Citation ORG.LETTERS,6,1417(2004)
Literature Reference DOI 10.1021/ol049668z
Solvent CDCl3
Source File Reference UWLU50838