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Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-[(4-chlorophenyl)amino]-5,6-dihydro-1,3-dimethyl-6-phenyl-
SpectraBase Compound ID 22iaVQxRhhj
InChI InChI=1S/C20H18ClN5O2/c1-24-17-16(18(27)25(2)20(24)28)12-26(15-6-4-3-5-7-15)19(23-17)22-14-10-8-13(21)9-11-14/h3-11H,12H2,1-2H3,(H,22,23)
InChIKey JMNRAUQLCWYKCQ-UHFFFAOYSA-N
Mol Weight 395.85 g/mol
Molecular Formula C20H18ClN5O2
Exact Mass 395.114903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2UqIpL0IiE9
Name 7-(4-Chloro-phenyl)amino-1,3-dimethyl-6-phenyl-12,3,4,5,6-hexahydro-pyrimido(4,5-D)pyrimidine
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H18ClN5O2
InChI InChI=1S/C20H18ClN5O2/c1-24-17-16(18(27)25(2)20(24)28)12-26(15-6-4-3-5-7-15)19(23-17)22-14-10-8-13(21)9-11-14/h3-11H,12H2,1-2H3,(H,22,23)
InChIKey JMNRAUQLCWYKCQ-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 DMSO-D6