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6-(4-Methoxy-phenyl)-1,3-dimethyl-7-(4-tolyl)imino-2,4-dioxo-1,2,3,4,6,7-hexahydro-pyrimido(4,5-D)pyrimidine
SpectraBase Compound ID DkquM8VsfXv
InChI InChI=1S/C22H21N5O3/c1-14-5-7-15(8-6-14)23-21-24-19-18(20(28)26(3)22(29)25(19)2)13-27(21)16-9-11-17(30-4)12-10-16/h5-13H,1-4H3/b23-21-
InChIKey MARUOOONARJULI-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 5HKfQBbhTsn
Name 6-(4-Methoxy-phenyl)-1,3-dimethyl-7-(4-tolyl)imino-2,4-dioxo-1,2,3,4,6,7-hexahydro-pyrimido(4,5-D)pyrimidine
Comments Reassigned 21/22 Mgr.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H21N5O3
InChI InChI=1S/C22H21N5O3/c1-14-5-7-15(8-6-14)23-21-24-19-18(20(28)26(3)22(29)25(19)2)13-27(21)16-9-11-17(30-4)12-10-16/h5-13H,1-4H3/b23-21-
InChIKey MARUOOONARJULI-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