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1-[3-[(4-chloro-2,3,5,6-tetrafluorophenyl)amino]propyl]azepan-2-one
SpectraBase Compound ID 7ByqXCEKz9I
InChI InChI=1S/C15H17ClF4N2O/c16-10-11(17)13(19)15(14(20)12(10)18)21-6-4-8-22-7-3-1-2-5-9(22)23/h21H,1-8H2
InChIKey IGQIWLZWUCIXFT-UHFFFAOYSA-N
Mol Weight 352.76 g/mol
Molecular Formula C15H17ClF4N2O
Exact Mass 352.096554 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EGxarHypY8K
Name 1-[3-[(4-chloro-2,3,5,6-tetrafluorophenyl)amino]propyl]azepan-2-one
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H17ClF4N2O
InChI InChI=1S/C15H17ClF4N2O/c16-10-11(17)13(19)15(14(20)12(10)18)21-6-4-8-22-7-3-1-2-5-9(22)23/h21H,1-8H2
InChIKey IGQIWLZWUCIXFT-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 UWMS26346