For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 1 NMR

3-CYANO-4-TRIFLUOROMETHYL-2,6-BIS-[3'-(N-TOLUENESULFONYL-6'-BROMOINDOLYL)]-PYRIDINE
SpectraBase Compound ID FTueDhuacXK
InChI InChI=1S/C37H23Br2F3N4O4S2/c1-21-3-9-25(10-4-21)51(47,48)45-19-30(27-13-7-23(38)15-34(27)45)33-17-32(37(40,41)42)29(18-43)36(44-33)31-20-46(35-16-24(39)8-14-28(31)35)52(49,50)26-11-5-22(2)6-12-26/h3-17,19-20H,1-2H3
InChIKey BBXDPCZFWFUMLR-UHFFFAOYSA-N
Mol Weight 868.5 g/mol
Molecular Formula C37H23Br2F3N4O4S2
Exact Mass 865.947958 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2Kn0SJlqJsk
Name 3-CYANO-4-TRIFLUOROMETHYL-2,6-BIS-[3'-(N-TOLUENESULFONYL-6'-BROMOINDOLYL)]-PYRIDINE
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H23Br2F3N4O4S2
InChI InChI=1S/C37H23Br2F3N4O4S2/c1-21-3-9-25(10-4-21)51(47,48)45-19-30(27-13-7-23(38)15-34(27)45)33-17-32(37(40,41)42)29(18-43)36(44-33)31-20-46(35-16-24(39)8-14-28(31)35)52(49,50)26-11-5-22(2)6-12-26/h3-17,19-20H,1-2H3
InChIKey BBXDPCZFWFUMLR-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 Unknown
Source File Reference UWMS21963