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2-(4-(4-BROMOPHENYLSULFONYL)-PHENYL)-6-(4-FLUOROPHENYL)-THIAZOLO-[3,2-B]-[1,2,4]-TRIAZOLE
SpectraBase Compound ID FiJ8JQk3M3I
InChI InChI=1S/C22H13BrFN3O2S2/c23-16-5-11-19(12-6-16)31(28,29)18-9-3-15(4-10-18)21-25-22-27(26-21)20(13-30-22)14-1-7-17(24)8-2-14/h1-13H
InChIKey RNPNNTKELGXFTH-UHFFFAOYSA-N
Mol Weight 514.39 g/mol
Molecular Formula C22H13BrFN3O2S2
Exact Mass 512.96166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bjzok877tog
Name 2-(4-(4-BROMOPHENYLSULFONYL)-PHENYL)-6-(4-FLUOROPHENYL)-THIAZOLO-[3,2-B]-[1,2,4]-TRIAZOLE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H13BrFN3O2S2
InChI InChI=1S/C22H13BrFN3O2S2/c23-16-5-11-19(12-6-16)31(28,29)18-9-3-15(4-10-18)21-25-22-27(26-21)20(13-30-22)14-1-7-17(24)8-2-14/h1-13H
InChIKey RNPNNTKELGXFTH-UHFFFAOYSA-N
Literature Reference Author S.F.BARBUCEANU,C.DRAGHICI,F.BARBUCEANU,G.BANCESCU,G.SARAMET
Literature Reference Citation CHEM.PHARM.BULL.,63,694(2015)
Literature Reference DOI 10.1248/cpb.c15-00379
Molecular Weight 514.387 g/mol
Solvent DMSO-D6
Source File Reference UWPA10118