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(Z)-5-BROMO-N(4)-(4-BROMO-2-FLUOROPHENYL)-N(6)-(4-CHLORO-5H-1,2,3-DITHIAZOL-5-YLIDENE)-QUINAZOLINE-4,6-DIAMINE
SpectraBase Compound ID KQuUQVnFbkr
InChI InChI=1S/C16H7Br2ClFN5S2/c17-7-1-2-9(8(20)5-7)23-15-12-10(21-6-22-15)3-4-11(13(12)18)24-16-14(19)25-27-26-16/h1-6H,(H,21,22,23)/b24-16-
InChIKey ZTKYTKCZTZGNFB-JLPGSUDCSA-N
Mol Weight 547.65 g/mol
Molecular Formula C16H7Br2ClFN5S2
Exact Mass 544.818219 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ESPPy7pe3y7
Name (Z)-5-BROMO-N(4)-(4-BROMO-2-FLUOROPHENYL)-N(6)-(4-CHLORO-5H-1,2,3-DITHIAZOL-5-YLIDENE)-QUINAZOLINE-4,6-DIAMINE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H7Br2ClFN5S2
InChI InChI=1S/C16H7Br2ClFN5S2/c17-7-1-2-9(8(20)5-7)23-15-12-10(21-6-22-15)3-4-11(13(12)18)24-16-14(19)25-27-26-16/h1-6H,(H,21,22,23)/b24-16-
InChIKey ZTKYTKCZTZGNFB-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 UWLU81423