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4-Cyano-6-(n-hexylamino)-2,7-diphenyl-pyrimido[5,4-c]pyridazine-3,8-dione
SpectraBase Compound ID 1JhKM78HBIu
InChI InChI=1S/C25H24N6O2/c1-2-3-4-11-16-27-25-28-21-20(17-26)23(32)31(19-14-9-6-10-15-19)29-22(21)24(33)30(25)18-12-7-5-8-13-18/h5-10,12-15H,2-4,11,16H2,1H3,(H,27,28)
InChIKey RMUWUIUOZUXKFS-UHFFFAOYSA-N
Mol Weight 440.51 g/mol
Molecular Formula C25H24N6O2
Exact Mass 440.196074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ct73IfSOq2w
Name 4-Cyano-6-(n-hexylamino)-2,7-diphenyl-pyrimido[5,4-c]pyridazine-3,8-dione
Comments Less than 3 mono-isotopic peaks
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Formula C25H24N6O2
InChI InChI=1S/C25H24N6O2/c1-2-3-4-11-16-27-25-28-21-20(17-26)23(32)31(19-14-9-6-10-15-19)29-22(21)24(33)30(25)18-12-7-5-8-13-18/h5-10,12-15H,2-4,11,16H2,1H3,(H,27,28)
InChIKey RMUWUIUOZUXKFS-UHFFFAOYSA-N
Molecular Weight 440.507 g/mol
SMILES N(C=1N(C(C=2C(=C(C#N)C(N(N2)c2ccccc2)=O)N1)=O)c1ccccc1)CCCCCC
SPLASH splash10-0006-0000900000-5c9f0333402eadba6cda
Source of Spectrum Y-49-391-5c
Wiley ID 1706541