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4-ETHYL-7-METHYL-6,9-DIPHENYL-4,6,10,11-TETRAHYDRO-PYRAZOLO-[5,4-B]-1,2,3,4-TETRAAZOLO-[1',5'-2,1]-PYRIMIDINO-[5,6-E]-PYRIDIN-5-ONE

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4-ETHYL-7-METHYL-6,9-DIPHENYL-4,6,10,11-TETRAHYDRO-PYRAZOLO-[5,4-B]-1,2,3,4-TETRAAZOLO-[1',5'-2,1]-PYRIMIDINO-[5,6-E]-PYRIDIN-5-ONE
SpectraBase Compound ID 1LGgPWa9FJD
InChI InChI=1S/C23H20N8O/c1-3-29-22(32)19-18(15-10-6-4-7-11-15)17-14(2)26-30(16-12-8-5-9-13-16)20(17)24-21(19)31-23(29)25-27-28-31/h4-13,18,24H,3H2,1-2H3
InChIKey XTYCWDGQBHRBKT-UHFFFAOYSA-N
Mol Weight 424.47 g/mol
Molecular Formula C23H20N8O
Exact Mass 424.176007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XAt5S2Kan2
Name 4-ETHYL-7-METHYL-6,9-DIPHENYL-4,6,10,11-TETRAHYDRO-PYRAZOLO-[5,4-B]-1,2,3,4-TETRAAZOLO-[1',5'-2,1]-PYRIMIDINO-[5,6-E]-PYRIDIN-5-ONE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20N8O
InChI InChI=1S/C23H20N8O/c1-3-29-22(32)19-18(15-10-6-4-7-11-15)17-14(2)26-30(16-12-8-5-9-13-16)20(17)24-21(19)31-23(29)25-27-28-31/h4-13,18,24H,3H2,1-2H3
InChIKey XTYCWDGQBHRBKT-UHFFFAOYSA-N
Literature Reference Author T.I.EL-EMARY,S.A.A.EL-MOHSEN
Literature Reference Citation MOLECULES,17,14464(2012)
Literature Reference DOI 10.3390/molecules171214464
Molecular Weight 424.465 g/mol
Sample ID 922
Solvent DMSO-D6