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(+)-(S)-6-(DIFLUOROMETHYLPHENYL)-3-(1-PHENYLETHYL)-2,4-PYRIMIDINDIONE
SpectraBase Compound ID CzJAK5sEG4Y
InChI InChI=1S/C19H16F2N2O2/c1-13(14-8-4-2-5-9-14)23-17(24)12-16(22-18(23)25)19(20,21)15-10-6-3-7-11-15/h2-13H,1H3,(H,22,25)
InChIKey CIAGJIAEGPAALF-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C19H16F2N2O2
Exact Mass 342.117984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6AL8PxLwvAa
Name (+)-(S)-6-(DIFLUOROMETHYLPHENYL)-3-(1-PHENYLETHYL)-2,4-PYRIMIDINDIONE
Compound Number 5G
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Formula C19H16F2N2O2
InChI InChI=1S/C19H16F2N2O2/c1-13(14-8-4-2-5-9-14)23-17(24)12-16(22-18(23)25)19(20,21)15-10-6-3-7-11-15/h2-13H,1H3,(H,22,25)
InChIKey CIAGJIAEGPAALF-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
Molecular Weight 342.345 g/mol
Sample ID 50829
Solvent CDCl3