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N-(4-Tolyl)-1-(4-bromo-benzoylmethyl)-5,6-dimethyl-furo(2,3-D)pyrimidin-4-amine cation
SpectraBase Compound ID 4tIJ2ZjYcck
InChI InChI=1S/C23H20BrN3O2/c1-14-4-10-19(11-5-14)26-22-21-15(2)16(3)29-23(21)27(13-25-22)12-20(28)17-6-8-18(24)9-7-17/h4-11,13H,12H2,1-3H3/p+1
InChIKey PEKSFMIGSCIQAY-UHFFFAOYSA-O
Mol Weight 451.34 g/mol
Molecular Formula C23H21BrN3O2
Exact Mass 450.081715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E7rHLD3CKJl
Name N-(4-Tolyl)-1-(4-bromo-benzoylmethyl)-5,6-dimethyl-furo(2,3-D)pyrimidin-4-amine cation
Comments bromide
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Formula C23H21BrN3O2
InChI InChI=1S/C23H20BrN3O2/c1-14-4-10-19(11-5-14)26-22-21-15(2)16(3)29-23(21)27(13-25-22)12-20(28)17-6-8-18(24)9-7-17/h4-11,13H,12H2,1-3H3/p+1
InChIKey PEKSFMIGSCIQAY-UHFFFAOYSA-O
Instrument Name Jeol FX-60
Literature Reference F. Johannsen, A. Jorgensen, Chemica Scripta 26, 337 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3