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2-(3-((2-FLUOROTHIAZOL-4-YL)-ETHYNYL)-PHENYL)-ACETONITRILE

View entire compound with spectra: 1 NMR

2-(3-((2-FLUOROTHIAZOL-4-YL)-ETHYNYL)-PHENYL)-ACETONITRILE
SpectraBase Compound ID H09BvxiteNZ
InChI InChI=1S/C13H7FN2S/c14-13-16-12(9-17-13)5-4-10-2-1-3-11(8-10)6-7-15/h1-3,8-9H,6H2
InChIKey SPURXWRBPVNQJO-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C13H7FN2S
Exact Mass 242.031398 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpXjzPbXU3H
Name 2-(3-((2-FLUOROTHIAZOL-4-YL)-ETHYNYL)-PHENYL)-ACETONITRILE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H7FN2S
InChI InChI=1S/C13H7FN2S/c14-13-16-12(9-17-13)5-4-10-2-1-3-11(8-10)6-7-15/h1-3,8-9H,6H2
InChIKey SPURXWRBPVNQJO-UHFFFAOYSA-N
Literature Reference Author F.G.SIMEON,M.T.WENDAHL,V.W.PIKE
Literature Reference Citation J.MED.CHEM.,54,901(2011)
Literature Reference DOI 10.1021/jm101430m
Solvent CDCl3
Source File Reference UWMZ34512