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4-TRIFLUOROMETHYL-2,6-BIS-[3'-(N-TOLUENESULFONYL-6'-BROMOINDOLYL)]-PYRIDINE

View entire compound with spectra: 2 NMR

4-TRIFLUOROMETHYL-2,6-BIS-[3'-(N-TOLUENESULFONYL-6'-BROMOINDOLYL)]-PYRIDINE
SpectraBase Compound ID 4Jo7L53pMc2
InChI InChI=1S/C36H24Br2F3N3O4S2/c1-21-3-9-26(10-4-21)49(45,46)43-19-30(28-17-24(37)7-13-34(28)43)32-15-23(36(39,40)41)16-33(42-32)31-20-44(35-14-8-25(38)18-29(31)35)50(47,48)27-11-5-22(2)6-12-27/h3-20H,1-2H3
InChIKey RJVWPMPPJRJVFK-UHFFFAOYSA-N
Mol Weight 843.5 g/mol
Molecular Formula C36H24Br2F3N3O4S2
Exact Mass 840.952709 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZSw5fX48G8
Name 4-TRIFLUOROMETHYL-2,6-BIS-[3'-(N-TOLUENESULFONYL-6'-BROMOINDOLYL)]-PYRIDINE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H24Br2F3N3O4S2
InChI InChI=1S/C36H24Br2F3N3O4S2/c1-21-3-9-26(10-4-21)49(45,46)43-19-30(28-17-24(37)7-13-34(28)43)32-15-23(36(39,40)41)16-33(42-32)31-20-44(35-14-8-25(38)18-29(31)35)50(47,48)27-11-5-22(2)6-12-27/h3-20H,1-2H3
InChIKey RJVWPMPPJRJVFK-UHFFFAOYSA-N
Literature Reference Author W.N.XIONG,C.G.YANG,B.JIANG
Literature Reference Citation BIOORG.MED.CHEM.,9,1773(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00070-0
Solvent CDCl3
Source File Reference UWMS21970