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2,2-DIMETHYL-N-(2-(3-FLUORO-4-(2-PIVALOYLAMINOPHENYL)-QUINOL-2-YL)-PHENYL)-PROPANAMIDE
SpectraBase Compound ID 2jHUWpkj753
InChI InChI=1S/C31H32FN3O2/c1-30(2,3)28(36)34-23-17-11-8-14-20(23)25-19-13-7-10-16-22(19)33-27(26(25)32)21-15-9-12-18-24(21)35-29(37)31(4,5)6/h7-18H,1-6H3,(H,34,36)(H,35,37)
InChIKey HDUDBYWQYCVTCY-UHFFFAOYSA-N
Mol Weight 497.6 g/mol
Molecular Formula C31H32FN3O2
Exact Mass 497.247855 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EpapndvqfDX
Name 2,2-DIMETHYL-N-(2-(3-FLUORO-4-(2-PIVALOYLAMINOPHENYL)-QUINOL-2-YL)-PHENYL)-PROPANAMIDE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H32FN3O2
InChI InChI=1S/C31H32FN3O2/c1-30(2,3)28(36)34-23-17-11-8-14-20(23)25-19-13-7-10-16-22(19)33-27(26(25)32)21-15-9-12-18-24(21)35-29(37)31(4,5)6/h7-18H,1-6H3,(H,34,36)(H,35,37)
InChIKey HDUDBYWQYCVTCY-UHFFFAOYSA-N
Literature Reference Author E.ARZEL,P.ROCCA,P.GRELLIER,M.LABAEID,F.FRAPPIER,F.GUERITTE,C .GASPARD,F.MARSAIS,A
Literature Reference Citation J.MED.CHEM.,44,949(2001)
Literature Reference DOI 10.1021/jm0010419
Solvent CDCl3
Source File Reference UWSI44377