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5-METHYL-2-(4-METHYLPHENYL)-6H-INDENO-[2,1-E]-PYRAZOLO-[1,5-A]-PYRIMIDIN-6-ONE
SpectraBase Compound ID 5VpXCPGH5Vg
InChI InChI=1S/C21H15N3O/c1-12-7-9-14(10-8-12)17-11-18-22-13(2)19-20(24(18)23-17)15-5-3-4-6-16(15)21(19)25/h3-11H,1-2H3
InChIKey BZLVFLSEXAXNIR-UHFFFAOYSA-N
Mol Weight 325.37 g/mol
Molecular Formula C21H15N3O
Exact Mass 325.121512 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5zZ8kAdusoq
Name 5-METHYL-2-(4-METHYLPHENYL)-6H-INDENO-[2,1-E]-PYRAZOLO-[1,5-A]-PYRIMIDIN-6-ONE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H15N3O
InChI InChI=1S/C21H15N3O/c1-12-7-9-14(10-8-12)17-11-18-22-13(2)19-20(24(18)23-17)15-5-3-4-6-16(15)21(19)25/h3-11H,1-2H3
InChIKey BZLVFLSEXAXNIR-UHFFFAOYSA-N
Literature Reference Author J.QUIROGA,J.PORTILLA,S.CRUZ,R.ABONIA,B.INSUASTY,M.NOGUERAS,J .COBO,M.HURSTHOUSE
Literature Reference Citation OPEN.ORG.CHEM.J.,2,92(2008)
Literature Reference DOI 10.2174/1874095200801020092
Molecular Weight 325.370 g/mol
Solvent DMSO-D6
Source File Reference UWLU81083