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Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 5,6-dihydro-1,3-dimethyl-7-[(4-methylphenyl)amino]-6-phenyl-
SpectraBase Compound ID H90G6QKyD5p
InChI InChI=1S/C21H21N5O2/c1-14-9-11-15(12-10-14)22-20-23-18-17(19(27)25(3)21(28)24(18)2)13-26(20)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3,(H,22,23)
InChIKey ORCSICNPJBMVLN-UHFFFAOYSA-N
Mol Weight 375.43 g/mol
Molecular Formula C21H21N5O2
Exact Mass 375.169525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zgU70OWdBw
Name 1,3-Dimethyl-6-phenyl-7-(4-tolyl)amino-1,2,3,4,5,6-hexahydro-pyrimido(4,5-D)pyrimidine
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Formula C21H21N5O2
InChI InChI=1S/C21H21N5O2/c1-14-9-11-15(12-10-14)22-20-23-18-17(19(27)25(3)21(28)24(18)2)13-26(20)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3,(H,22,23)
InChIKey ORCSICNPJBMVLN-UHFFFAOYSA-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