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7-(4-Methoxy-phenyl)imino-1,3-dimethyl-6-(4-tolyl)-2,4-dioxo-1,2,3,4,6,7-hexahydro-pyrimido(4,5-D)pyrimidine
SpectraBase Compound ID 5t1YxuqMYer
InChI InChI=1S/C22H21N5O3/c1-14-5-9-16(10-6-14)27-13-18-19(25(2)22(29)26(3)20(18)28)24-21(27)23-15-7-11-17(30-4)12-8-15/h5-13H,1-4H3/b23-21-
InChIKey QAEHFGSTZYPPSA-LNVKXUELSA-N
Mol Weight 403.44 g/mol
Molecular Formula C22H21N5O3
Exact Mass 403.16444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fbv3NBSXmVi
Name 7-(4-Methoxy-phenyl)imino-1,3-dimethyl-6-(4-tolyl)-2,4-dioxo-1,2,3,4,6,7-hexahydro-pyrimido(4,5-D)pyrimidine
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Formula C22H21N5O3
InChI InChI=1S/C22H21N5O3/c1-14-5-9-16(10-6-14)27-13-18-19(25(2)22(29)26(3)20(18)28)24-21(27)23-15-7-11-17(30-4)12-8-15/h5-13H,1-4H3/b23-21-
InChIKey QAEHFGSTZYPPSA-LNVKXUELSA-N
Instrument Name Bruker AC-200
Literature Reference P. Molina, M.J. Vilaplana, J. Perez, Tetrahedron 46, 7855 (1990).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3