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4-(5-cyano-2-pyridinyl)benzoic acid methyl ester
SpectraBase Compound ID 61agC94dfd2
InChI InChI=1S/C14H10N2O2/c1-18-14(17)12-5-3-11(4-6-12)13-7-2-10(8-15)9-16-13/h2-7,9H,1H3
InChIKey VRVUDGOKOSFBJL-UHFFFAOYSA-N
Mol Weight 238.25 g/mol
Molecular Formula C14H10N2O2
Exact Mass 238.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuZCvEDVWn6
Name 4-(5-cyano-2-pyridinyl)benzoic acid methyl ester
Alternate Name(s) 4-(5-cyano-2-pyridyl)benzoic acid methyl ester Methyl 4-(5-cyano-2-pyridyl)benzoate Methyl 4-(5-cyanopyridin-2-yl)benzoate
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Formula C14H10N2O2
InChI InChI=1S/C14H10N2O2/c1-18-14(17)12-5-3-11(4-6-12)13-7-2-10(8-15)9-16-13/h2-7,9H,1H3
InChIKey VRVUDGOKOSFBJL-UHFFFAOYSA-N
Molecular Weight 238.246 g/mol
SMILES c1(ncc(cc1)C#N)-c1ccc(C(=O)OC)cc1
SPLASH splash10-0a70-1390000000-91ed3df77117821fcee6
Source of Spectrum QA-40-178-6
Wiley ID 861578