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N-(6-methyl-2-pyridinyl)-4-[9-[4-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]phenyl]-1,10-phenanthrolin-2-yl]benzamide
SpectraBase Compound ID 72vcyQwn5VE
InChI InChI=1S/C38H28N6O2/c1-23-5-3-7-33(39-23)43-37(45)29-15-9-25(10-16-29)31-21-19-27-13-14-28-20-22-32(42-36(28)35(27)41-31)26-11-17-30(18-12-26)38(46)44-34-8-4-6-24(2)40-34/h3-22H,1-2H3,(H,39,43,45)(H,40,44,46)
InChIKey AOURPBOWFKRWTO-UHFFFAOYSA-N
Mol Weight 600.7 g/mol
Molecular Formula C38H28N6O2
Exact Mass 600.227374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HliOx2aNt5x
Name N-(6-methyl-2-pyridinyl)-4-[9-[4-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]phenyl]-1,10-phenanthrolin-2-yl]benzamide
Comments Less than 3 mono-isotopic peaks
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Formula C38H28N6O2
InChI InChI=1S/C38H28N6O2/c1-23-5-3-7-33(39-23)43-37(45)29-15-9-25(10-16-29)31-21-19-27-13-14-28-20-22-32(42-36(28)35(27)41-31)26-11-17-30(18-12-26)38(46)44-34-8-4-6-24(2)40-34/h3-22H,1-2H3,(H,39,43,45)(H,40,44,46)
InChIKey AOURPBOWFKRWTO-UHFFFAOYSA-N
Molecular Weight 600.682 g/mol
SMILES N(C(c1ccc(-c2nc3c4nc(-c5ccc(C(Nc6nc(C)ccc6)=O)cc5)ccc4ccc3cc2)cc1)=O)c1nc(C)ccc1
SPLASH splash10-0002-9000000000-529f85bdf82ca2719bf1
Source of Spectrum C-117-8455-2
Synonyms N-(6-methyl-2-pyridyl)-4-[9-[4-[(6-methyl-2-pyridyl)carbamoyl]phenyl]-1,10-phenanthrolin-2-yl]benzamide N-(6-methylpyridin-2-yl)-4-[9-[4-[(6-methylpyridin-2-yl)carbamoyl]phenyl]-1,10-phenanthrolin-2-yl]benzamide
Wiley ID 758984