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7-(4-Tolyl)imino-1,3-dimethyl-6-phenyl-2,4-dioxo-1,2,3,4,6,7-hexahydro-pyrimido(4,5-D)pyrimidine
SpectraBase Compound ID CTtn477yKi
InChI InChI=1S/C21H19N5O2/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/h4-13H,1-3H3/b22-20-
InChIKey BURVCGFAXOJBLX-XDOYNYLZSA-N
Mol Weight 373.42 g/mol
Molecular Formula C21H19N5O2
Exact Mass 373.153875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HMy78yfYT5l
Name 7-(4-Tolyl)imino-1,3-dimethyl-6-phenyl-2,4-dioxo-1,2,3,4,6,7-hexahydro-pyrimido(4,5-D)pyrimidine
Comments CDCL3/TFA AS SOLVENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H19N5O2
InChI InChI=1S/C21H19N5O2/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/h4-13H,1-3H3/b22-20-
InChIKey BURVCGFAXOJBLX-XDOYNYLZSA-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 Mixture