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1-[3-[(4-chloro-2,3,5,6-tetrafluoro-phenyl)amino]propyl]-2-pyrrolidone
SpectraBase Compound ID LGRyWu7tbyx
InChI InChI=1S/C13H13ClF4N2O/c14-8-9(15)11(17)13(12(18)10(8)16)19-4-2-6-20-5-1-3-7(20)21/h19H,1-6H2
InChIKey GJBDRHSROUVERX-UHFFFAOYSA-N
Mol Weight 324.71 g/mol
Molecular Formula C13H13ClF4N2O
Exact Mass 324.065253 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ctr4IF5R7FH
Name 1-[3-[(4-chloro-2,3,5,6-tetrafluoro-phenyl)amino]propyl]-2-pyrrolidone
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13ClF4N2O
InChI InChI=1S/C13H13ClF4N2O/c14-8-9(15)11(17)13(12(18)10(8)16)19-4-2-6-20-5-1-3-7(20)21/h19H,1-6H2
InChIKey GJBDRHSROUVERX-UHFFFAOYSA-N
Literature Reference Author B.GIERCZYK,G.SCHROEDER,B.BRZEZINSKI
Literature Reference Citation J.ORG.CHEM.,68,3139(2003)
Literature Reference DOI 10.1021/jo026899f
Solvent CDCl3
Source File Reference UWMS26347