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1-[3-[(4-chloro-2,3,5,6-tetrafluorophenyl)-methylamino]propyl]-1,3-diazinan-2-one
SpectraBase Compound ID AXZXDxzoFJW
InChI InChI=1S/C14H16ClF4N3O/c1-21(5-3-7-22-6-2-4-20-14(22)23)13-11(18)9(16)8(15)10(17)12(13)19/h2-7H2,1H3,(H,20,23)
InChIKey KDUUEZNHKBXAOG-UHFFFAOYSA-N
Mol Weight 353.75 g/mol
Molecular Formula C14H16ClF4N3O
Exact Mass 353.091802 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9R7wKDIi1KS
Name 1-[3-[(4-chloro-2,3,5,6-tetrafluorophenyl)-methylamino]propyl]-1,3-diazinan-2-one
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16ClF4N3O
InChI InChI=1S/C14H16ClF4N3O/c1-21(5-3-7-22-6-2-4-20-14(22)23)13-11(18)9(16)8(15)10(17)12(13)19/h2-7H2,1H3,(H,20,23)
InChIKey KDUUEZNHKBXAOG-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 UWMS26343