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2,6-bis(2-pyridinyl)-4-pyridinecarboxylic acid butyl ester
SpectraBase Compound ID 9UujrpRVVXx
InChI InChI=1S/C20H19N3O2/c1-2-3-12-25-20(24)15-13-18(16-8-4-6-10-21-16)23-19(14-15)17-9-5-7-11-22-17/h4-11,13-14H,2-3,12H2,1H3
InChIKey GMSWATKNAXIMOC-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C20H19N3O2
Exact Mass 333.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKrW8vXSyRO
Name 2,6-bis(2-pyridinyl)-4-pyridinecarboxylic acid butyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C20H19N3O2
InChI InChI=1S/C20H19N3O2/c1-2-3-12-25-20(24)15-13-18(16-8-4-6-10-21-16)23-19(14-15)17-9-5-7-11-22-17/h4-11,13-14H,2-3,12H2,1H3
InChIKey GMSWATKNAXIMOC-UHFFFAOYSA-N
Molecular Weight 333.391 g/mol
SMILES c1(nc(cc(c1)C(=O)OCCCC)-c1ncccc1)-c1ncccc1
SPLASH splash10-001i-0029000000-f186ff4d2ff7bf857955
Source of Spectrum J-65-7762-8
Synonyms 2,6-bis(2-pyridyl)isonicotinic acid butyl ester butyl 2,6-bis(2-pyridyl)pyridine-4-carboxylate butyl 2,6-dipyridin-2-ylpyridine-4-carboxylate
Wiley ID 1533674