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3-(4-Iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-tetraazol-2-ium chloride

View entire compound with spectra: 3 NMR, 6 FTIR, 3 Raman, and 1 UV-Vis

3-(4-Iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-tetraazol-2-ium chloride
SpectraBase Compound ID EUJ1g2VlDGB
InChI InChI=1S/C19H13IN5O2.ClH/c20-15-6-8-16(9-7-15)23-21-19(14-4-2-1-3-5-14)22-24(23)17-10-12-18(13-11-17)25(26)27;/h1-13H;1H/q+1;/p-1
InChIKey JORABGDXCIBAFL-UHFFFAOYSA-M
Mol Weight 505.7 g/mol
Molecular Formula C19H13ClIN5O2
Exact Mass 504.980247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1656i6QrP0y
Name 2-(p-IODOPHENYL)-3-(p-NITROPHENYL)-5-PHENYL-2H-TETRAZOLIUM CHLORIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13ClIN5O2
InChI InChI=1S/C19H13IN5O2.ClH/c20-15-6-8-16(9-7-15)23-21-19(14-4-2-1-3-5-14)22-24(23)17-10-12-18(13-11-17)25(26)27;/h1-13H;1H/q+1;/p-1
InChIKey JORABGDXCIBAFL-UHFFFAOYSA-M
Molecular Weight 505.71
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Varian CFT-20