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4-(11-keto-3-methyl-8,9,10,12-tetrahydro-7H-benzo[b][4,7]phenanthrolin-12-yl)benzoic acid methyl ester
SpectraBase Compound ID 5TiJTV8JxEl
InChI InChI=1S/C25H22N2O3/c1-14-6-11-17-18(26-14)12-13-20-23(17)22(24-19(27-20)4-3-5-21(24)28)15-7-9-16(10-8-15)25(29)30-2/h6-13,22,27H,3-5H2,1-2H3
InChIKey PMOYQRUNVJBSRB-UHFFFAOYSA-N
Mol Weight 398.46 g/mol
Molecular Formula C25H22N2O3
Exact Mass 398.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Gwblqp45Dz
Name 4-(11-keto-3-methyl-8,9,10,12-tetrahydro-7H-benzo[b][4,7]phenanthrolin-12-yl)benzoic acid methyl ester
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Formula C25H22N2O3
InChI InChI=1S/C25H22N2O3/c1-14-6-11-17-18(26-14)12-13-20-23(17)22(24-19(27-20)4-3-5-21(24)28)15-7-9-16(10-8-15)25(29)30-2/h6-13,22,27H,3-5H2,1-2H3
InChIKey PMOYQRUNVJBSRB-UHFFFAOYSA-N
Molecular Weight 398.462 g/mol
SMILES N1c2c(C(C3=C1CCCC3=O)c1ccc(C(=O)OC)cc1)c1ccc(nc1cc2)C
SPLASH splash10-03di-1291000000-823d96b09248b4ed3e6b
Synonyms 4-(3-Methyl-11-oxo-8,9,10,12-tetrahydro-7H-benzo[b][4,7]phenanthrolin-12-yl)benzoic acid methyl ester Methyl 4-(3-methyl-11-oxidanylidene-8,9,10,12-tetrahydro-7H-benzo[b][4,7]phenanthrolin-12-yl)benzoate Methyl 4-(3-methyl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[b][4,7]phenanthrolin-12-yl)benzoate Methyl 4-(3-methyl-11-oxo-8,9,10,12-tetrahydro-7H-benzo[b][4,7]phenanthrolin-12-yl)benzoate
Wiley ID 1461091