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2,4-Dimethyl-6-(phenylamino)-1H,2H-isoquino[2',1':3,4]pyrimido[4,5-d]pyrimidine-1,3-(2H,4H)-dione

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2,4-Dimethyl-6-(phenylamino)-1H,2H-isoquino[2',1':3,4]pyrimido[4,5-d]pyrimidine-1,3-(2H,4H)-dione
SpectraBase Compound ID LlBKPpwt9dh
InChI InChI=1S/C22H19N5O2/c1-25-19-17(20(28)26(2)22(25)29)18-16-11-7-6-8-14(16)12-13-27(18)21(24-19)23-15-9-4-3-5-10-15/h3-13,18H,1-2H3,(H,23,24)
InChIKey GHJIINBNYGBCBZ-UHFFFAOYSA-N
Mol Weight 385.43 g/mol
Molecular Formula C22H19N5O2
Exact Mass 385.153875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9P1h7GmoZc8
Name 2,4-DIMETHYL-6-(PHENYLAMINO)-1-H,2-H-ISOQUINO-[2',1':3,4]-PYRIMIDO-[4.5-D]-PYRIMIDINE-1,3-(2-H,4-H)-DIONE
Compound Number 14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19N5O2
InChI InChI=1S/C22H19N5O2/c1-25-19-17(20(28)26(2)22(25)29)18-16-11-7-6-8-14(16)12-13-27(18)21(24-19)23-15-9-4-3-5-10-15/h3-13,18H,1-2H3,(H,23,24)
InChIKey GHJIINBNYGBCBZ-UHFFFAOYSA-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 385.425 g/mol
Solvent CD2Cl2
Source File Reference UWMZ1586