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3-(2',3',4',5',6'-PENTAFLUOROPHENYL)-3-HYDROXY-2-METHYLENE-PROPIONITRILE
SpectraBase Compound ID BKNtja1mIn7
InChI InChI=1S/C10H4F5NO/c1-3(2-16)10(17)4-5(11)7(13)9(15)8(14)6(4)12/h10,17H,1H2
InChIKey SMLWZBPXSZLWKD-UHFFFAOYSA-N
Mol Weight 249.14 g/mol
Molecular Formula C10H4F5NO
Exact Mass 249.021305 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AQsuPGaHzA
Name 3-(2',3',4',5',6'-PENTAFLUOROPHENYL)-3-HYDROXY-2-METHYLENE-PROPIONITRILE
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H4F5NO
InChI InChI=1S/C10H4F5NO/c1-3(2-16)10(17)4-5(11)7(13)9(15)8(14)6(4)12/h10,17H,1H2
InChIKey SMLWZBPXSZLWKD-UHFFFAOYSA-N
Literature Reference Author M.V.R.REDDY,M.T.RUDD,P.V.RAMACHANDRAN
Literature Reference Citation J.ORG.CHEM.,67,5382(2002)
Literature Reference DOI 10.1021/jo025591l
Solvent CDCl3
Source File Reference UWVN23414