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N,N'-(1,4-Phenylene)bis(5-cyano-6-oxo-2-phenyl-1,6-dihydropyridine-3-carboxamide)
SpectraBase Compound ID 3On9ZHN3RY5
InChI InChI=1S/C32H20N6O4/c33-17-21-15-25(27(37-29(21)39)19-7-3-1-4-8-19)31(41)35-23-11-13-24(14-12-23)36-32(42)26-16-22(18-34)30(40)38-28(26)20-9-5-2-6-10-20/h1-16H,(H,35,41)(H,36,42)(H,37,39)(H,38,40)
InChIKey SOLJOEKFQDPTOO-UHFFFAOYSA-N
Mol Weight 552.6 g/mol
Molecular Formula C32H20N6O4
Exact Mass 552.154603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Ug2vqg02ve
Name N,N'-(1,4-Phenylene)bis(5-cyano-6-oxo-2-phenyl-1,6-dihydropyridine-3-carboxamide)
Alternate Name(s) 5-cyano-N-[4-[[(5-cyano-6-oxo-2-phenyl-1H-pyridin-3-yl)-oxomethyl]amino]phenyl]-6-oxo-2-phenyl-1H-pyridine-3-carboxamide 5-cyano-N-[4-[(5-cyano-6-oxo-2-phenyl-1H-pyridine-3-carbonyl)amino]phenyl]-6-oxo-2-phenyl-1H-pyridine-3-carboxamide 5-cyano-N-[4-[(5-cyano-6-oxidanylidene-2-phenyl-1H-pyridin-3-yl)carbonylamino]phenyl]-6-oxidanylidene-2-phenyl-1H-pyridine-3-carboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H20N6O4
InChI InChI=1S/C32H20N6O4/c33-17-21-15-25(27(37-29(21)39)19-7-3-1-4-8-19)31(41)35-23-11-13-24(14-12-23)36-32(42)26-16-22(18-34)30(40)38-28(26)20-9-5-2-6-10-20/h1-16H,(H,35,41)(H,36,42)(H,37,39)(H,38,40)
InChIKey SOLJOEKFQDPTOO-UHFFFAOYSA-N
Molecular Weight 552.550 g/mol
SMILES N1C(C(=CC(C(Nc2ccc(NC(C3=C(NC(C(=C3)C#N)=O)c3ccccc3)=O)cc2)=O)=C1c1ccccc1)C#N)=O
SPLASH splash10-0udi-0000090000-07ed6e1b12baf102b50a
Source of Spectrum Y-49-386-14
Wiley ID 1706547