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4-(3-cyano-4-pyridinyl)benzoic acid methyl ester

View entire compound with spectra: 3 MS (GC)

4-(3-cyano-4-pyridinyl)benzoic acid methyl ester
SpectraBase Compound ID 2LOYihZHiwT
InChI InChI=1S/C14H10N2O2/c1-18-14(17)11-4-2-10(3-5-11)13-6-7-16-9-12(13)8-15/h2-7,9H,1H3
InChIKey GLHJZUNDHVZCEF-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 6TJMEWVlYi0
Name 4-(3-cyano-4-pyridinyl)benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10N2O2
InChI InChI=1S/C14H10N2O2/c1-18-14(17)11-4-2-10(3-5-11)13-6-7-16-9-12(13)8-15/h2-7,9H,1H3
InChIKey GLHJZUNDHVZCEF-UHFFFAOYSA-N
Molecular Weight 238.246 g/mol
SMILES C(#N)c1c(-c2ccc(C(=O)OC)cc2)ccnc1
SPLASH splash10-0a4i-0290000000-f363f4436665c77cc8a2
Source of Spectrum D1-1992-656-5
Synonyms Methyl 4-(3-cyanopyridin-4-yl)benzoate 4-(3-cyano-4-pyridyl)benzoic acid methyl ester Methyl 4-(3-cyano-4-pyridyl)benzoate
Wiley ID 834428