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Dimethyl 2-p-tolyl-5,6-diphenylpyridine-3,4-dicarboxylate
SpectraBase Compound ID Bfz05a5GaJE
InChI InChI=1S/C28H23NO4/c1-18-14-16-21(17-15-18)26-24(28(31)33-3)23(27(30)32-2)22(19-10-6-4-7-11-19)25(29-26)20-12-8-5-9-13-20/h4-17H,1-3H3
InChIKey MWNJHAZTIGFMQK-UHFFFAOYSA-N
Mol Weight 437.5 g/mol
Molecular Formula C28H23NO4
Exact Mass 437.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIvNKVI3P1b
Name Dimethyl 2-p-tolyl-5,6-diphenylpyridine-3,4-dicarboxylate
Alternate Name(s) dimethyl 2-(4-methylphenyl)-5,6-diphenyl-3,4-pyridinedicarboxylate
CAS Registry Number 75233-33-9
Comments Less than 3 mono-isotopic peaks
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Formula C28H23NO4
InChI InChI=1S/C28H23NO4/c1-18-14-16-21(17-15-18)26-24(28(31)33-3)23(27(30)32-2)22(19-10-6-4-7-11-19)25(29-26)20-12-8-5-9-13-20/h4-17H,1-3H3
InChIKey MWNJHAZTIGFMQK-UHFFFAOYSA-N
Molecular Weight 437.495 g/mol
SMILES c1(c(c(-c2ccccc2)c(nc1-c1ccc(cc1)C)-c1ccccc1)C(=O)OC)C(=O)OC
SPLASH splash10-000i-0000900000-a459100e875a9a0e7d48
Source of Spectrum J-45-4901-0
Wiley ID 1383862