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METHYL-3-[3-(2-CYANO-4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-PROPANOATE
SpectraBase Compound ID AcBqh2rjwjJ
InChI InChI=1S/C13H10FN3O3/c1-19-12(18)5-4-11-16-13(17-20-11)10-3-2-9(14)6-8(10)7-15/h2-3,6H,4-5H2,1H3
InChIKey FJHDYKIROAMXBV-UHFFFAOYSA-N
Mol Weight 275.24 g/mol
Molecular Formula C13H10FN3O3
Exact Mass 275.070619 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 55NA2iXnsH0
Name METHYL-3-[3-(2-CYANO-4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL]-PROPANOATE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10FN3O3
InChI InChI=1S/C13H10FN3O3/c1-19-12(18)5-4-11-16-13(17-20-11)10-3-2-9(14)6-8(10)7-15/h2-3,6H,4-5H2,1H3
InChIKey FJHDYKIROAMXBV-UHFFFAOYSA-N
Literature Reference Author T.RUEHL,W.DEUTHER-CONRAD,S.FISCHER,R.GUENTHER,L.HENNIG,H.KRA UTSCHEID,P.BRUST
Literature Reference Citation ORG.MED.CHEM.LETT.,2,32(2012)
Literature Reference DOI 10.1186/2191-2858-2-32
Solvent CDCl3
Source File Reference UWLU976350