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5-(4-FLUOROPHENYL)-7H,8H-PYRIMIDO-[1,6-B]-PYRIDAZIN-6,8-DIONE
SpectraBase Compound ID FyVdlaumKbr
InChI InChI=1S/C13H8FN3O2/c14-9-5-3-8(4-6-9)11-10-2-1-7-15-17(10)13(19)16-12(11)18/h1-7H,(H,16,18,19)
InChIKey PWLSHVZMHBOQLQ-UHFFFAOYSA-N
Mol Weight 257.22 g/mol
Molecular Formula C13H8FN3O2
Exact Mass 257.060055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 330qb3MEVNw
Name 5-(4-FLUOROPHENYL)-7H,8H-PYRIMIDO-[1,6-B]-PYRIDAZIN-6,8-DIONE
Compound Number 4G'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H8FN3O2
InChI InChI=1S/C13H8FN3O2/c14-9-5-3-8(4-6-9)11-10-2-1-7-15-17(10)13(19)16-12(11)18/h1-7H,(H,16,18,19)
InChIKey PWLSHVZMHBOQLQ-UHFFFAOYSA-N
Literature Reference Author F.HEROLD,M.KALUCKA,M.KROL,J.HEROLD,J.KLEPS,J.TURLO
Literature Reference Citation MOLECULES,12,2643(2007)
Literature Reference DOI 10.3390/12122643
Molecular Weight 257.224 g/mol
Sample ID 57541
Solvent CDCl3