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ETHYL_1,2,3,4-TETRAHYDRO-2,4-DIMETHYL-1,3-DIOXO-6-(PHENYLIMINO)-PYRIDO-[1',2':3,4]-PYRIMIDO-[4.5-D]-PYRIMIDINE-9-CARBOXYLATE

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ETHYL_1,2,3,4-TETRAHYDRO-2,4-DIMETHYL-1,3-DIOXO-6-(PHENYLIMINO)-PYRIDO-[1',2':3,4]-PYRIMIDO-[4.5-D]-PYRIMIDINE-9-CARBOXYLATE
SpectraBase Compound ID 1Fsde83Nli4
InChI InChI=1S/C21H19N5O4/c1-4-30-19(28)13-10-11-15-16-17(24(2)21(29)25(3)18(16)27)23-20(26(15)12-13)22-14-8-6-5-7-9-14/h5-12H,4H2,1-3H3/b22-20+
InChIKey IUFLXTCUECOTQJ-LSDHQDQOSA-N
Mol Weight 405.41 g/mol
Molecular Formula C21H19N5O4
Exact Mass 405.143704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2XjjQ0zIiPi
Name ETHYL_1,2,3,4-TETRAHYDRO-2,4-DIMETHYL-1,3-DIOXO-6-(PHENYLIMINO)-PYRIDO-[1',2':3,4]-PYRIMIDO-[4.5-D]-PYRIMIDINE-9-CARBOXYLATE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19N5O4
InChI InChI=1S/C21H19N5O4/c1-4-30-19(28)13-10-11-15-16-17(24(2)21(29)25(3)18(16)27)23-20(26(15)12-13)22-14-8-6-5-7-9-14/h5-12H,4H2,1-3H3/b22-20+
InChIKey IUFLXTCUECOTQJ-LSDHQDQOSA-N
Literature Reference Author H.WAMHOFF,A.SCHMIDT
Literature Reference Citation J.ORG.CHEM.,58,6976(1993)
Literature Reference DOI 10.1021/jo00077a013
Molecular Weight 405.413 g/mol
Solvent CDCl3;DMSO-D6
Source File Reference UWMZ1578