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(Z)-5-BROMO-N(4)-(3-CHLORO-4-FLUOROPHENYL)-N(6)-(4-CHLORO-5H-1,2,3-DITHIAZOL-5-YLIDENE)-QUINAZOLINE-4,6-DIAMINE
SpectraBase Compound ID IMSbKdCmuAC
InChI InChI=1S/C16H7BrCl2FN5S2/c17-13-11(24-16-14(19)25-27-26-16)4-3-10-12(13)15(22-6-21-10)23-7-1-2-9(20)8(18)5-7/h1-6H,(H,21,22,23)/b24-16-
InChIKey FVJLEVOXRXBIDG-JLPGSUDCSA-N
Mol Weight 503.2 g/mol
Molecular Formula C16H7BrCl2FN5S2
Exact Mass 500.868734 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lflf0Q7ZCmM
Name (Z)-5-BROMO-N(4)-(3-CHLORO-4-FLUOROPHENYL)-N(6)-(4-CHLORO-5H-1,2,3-DITHIAZOL-5-YLIDENE)-QUINAZOLINE-4,6-DIAMINE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H7BrCl2FN5S2
InChI InChI=1S/C16H7BrCl2FN5S2/c17-13-11(24-16-14(19)25-27-26-16)4-3-10-12(13)15(22-6-21-10)23-7-1-2-9(20)8(18)5-7/h1-6H,(H,21,22,23)/b24-16-
InChIKey FVJLEVOXRXBIDG-JLPGSUDCSA-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 DMSO-D6
Source File Reference UWLU81424