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3-(2-naphthoyl)-1,7-diphenyl-1H-[1,2,4]triazino[4,3-b][1,2,4,5]tetrazin-6(4H)-one
SpectraBase Compound ID E10tvp6smQp
InChI InChI=1S/C27H18N6O2/c34-24(21-16-15-18-9-7-8-12-20(18)17-21)25-30-32(22-13-5-2-6-14-22)27-29-28-23(26(35)33(27)31-25)19-10-3-1-4-11-19/h1-17H,(H,30,31)
InChIKey DFDHYZRAFPMUGW-UHFFFAOYSA-N
Mol Weight 458.48 g/mol
Molecular Formula C27H18N6O2
Exact Mass 458.149124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72d4KITNRAc
Name 3-(2-naphthoyl)-1,7-diphenyl-1H-[1,2,4]triazino[4,3-b][1,2,4,5]tetrazin-6(4H)-one
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Formula C27H18N6O2
InChI InChI=1S/C27H18N6O2/c34-24(21-16-15-18-9-7-8-12-20(18)17-21)25-30-32(22-13-5-2-6-14-22)27-29-28-23(26(35)33(27)31-25)19-10-3-1-4-11-19/h1-17H,(H,30,31)
InChIKey DFDHYZRAFPMUGW-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200001)342_1_96
Molecular Weight 458.481 g/mol
SMILES N1C(=NN(C=2N1C(C(=NN2)c1ccccc1)=O)c1ccccc1)C(=O)c1ccc2c(c1)cccc2
SPLASH splash10-0a6r-1900100000-e5ab0ef262f802d6ab86
Source of Spectrum JF-342-99-10j
Wiley ID 1766878