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9-(3-CHLORO-4-FLUOROPHENYLAMINO)-N-[2-(PIPERIDIN-1-YL)-ETHYL]-THIAZOLO-[5,4-F]-QUINAZOLINE-2-CARBOXIMIDAMIDE
SpectraBase Compound ID ETnBMtZ0ny5
InChI InChI=1S/C23H23ClFN7S/c24-15-12-14(4-5-16(15)25)30-22-19-17(28-13-29-22)6-7-18-20(19)33-23(31-18)21(26)27-8-11-32-9-2-1-3-10-32/h4-7,12-13H,1-3,8-11H2,(H2,26,27)(H,28,29,30)
InChIKey LIBWPTUGUAHVSV-UHFFFAOYSA-N
Mol Weight 484.0 g/mol
Molecular Formula C23H23ClFN7S
Exact Mass 483.140821 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOXMwsi03hr
Name 9-(3-CHLORO-4-FLUOROPHENYLAMINO)-N-[2-(PIPERIDIN-1-YL)-ETHYL]-THIAZOLO-[5,4-F]-QUINAZOLINE-2-CARBOXIMIDAMIDE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H23ClFN7S
InChI InChI=1S/C23H23ClFN7S/c24-15-12-14(4-5-16(15)25)30-22-19-17(28-13-29-22)6-7-18-20(19)33-23(31-18)21(26)27-8-11-32-9-2-1-3-10-32/h4-7,12-13H,1-3,8-11H2,(H2,26,27)(H,28,29,30)
InChIKey LIBWPTUGUAHVSV-UHFFFAOYSA-N
Literature Reference Author A.FOUCOURT,D.HEDOU,C.DUBOUILH-BENARD,L.DESIRE,A.S.CASAGRANDE ,B.LEBLOND,N.LOAEEC,
Literature Reference Citation MOLECULES,19,15546(2014)
Literature Reference DOI 10.3390/molecules191015546
Solvent CDCl3
Source File Reference UWLU81435