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2-(2-Pyridinylthio)benzoic acid methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-(2-Pyridinylthio)benzoic acid methyl ester
SpectraBase Compound ID 7dM3Nvf2F8k
InChI InChI=1S/C13H11NO2S/c1-16-13(15)10-6-2-3-7-11(10)17-12-8-4-5-9-14-12/h2-9H,1H3
InChIKey FZILFNSOAUUOIE-UHFFFAOYSA-N
Mol Weight 245.3 g/mol
Molecular Formula C13H11NO2S
Exact Mass 245.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfFK7vLf7qq
Name 2-(2-pyridinylthio)benzoic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO2S
InChI InChI=1S/C13H11NO2S/c1-16-13(15)10-6-2-3-7-11(10)17-12-8-4-5-9-14-12/h2-9H,1H3
InChIKey FZILFNSOAUUOIE-UHFFFAOYSA-N
Molecular Weight 245.296 g/mol
SMILES c1(c(Sc2ncccc2)cccc1)C(=O)OC
SPLASH splash10-000i-3920000000-11986b4cf65c1566de99
Source of Spectrum Y-30-1363-5
Synonyms 2-(2-pyridylthio)benzoic acid methyl ester Methyl 2-(2-pyridylsulfanyl)benzoate Methyl 2-pyridin-2-ylsulfanylbenzoate
Wiley ID 761213