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IR-786 iodide

View entire compound with spectra: 1 FTIR

IR-786 iodide
SpectraBase Compound ID eMhASSFfjk
InChI InChI=1S/C32H36ClN2.HI/c1-31(2)24-14-7-9-16-26(24)34(5)28(31)20-18-22-12-11-13-23(30(22)33)19-21-29-32(3,4)25-15-8-10-17-27(25)35(29)6;/h7-10,14-21H,11-13H2,1-6H3;1H/q+1;/p-1
InChIKey UOKPQDRVXJDDCA-UHFFFAOYSA-M
Mol Weight 611.0 g/mol
Molecular Formula C32H36ClIN2
Exact Mass 610.161172 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 7nMMwYkg2MC
Name IR-786 iodide
Source of Sample Aldrich
Catalog Number 424137
CAS Registry Number 56289-67-9
Classification Schiff bases, azobenzenes, indicators & dyes
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36ClIN2
InChI InChI=1S/C32H36ClN2.HI/c1-31(2)24-14-7-9-16-26(24)34(5)28(31)20-18-22-12-11-13-23(30(22)33)19-21-29-32(3,4)25-15-8-10-17-27(25)35(29)6;/h7-10,14-21H,11-13H2,1-6H3;1H/q+1;/p-1
InChIKey UOKPQDRVXJDDCA-UHFFFAOYSA-M
Purity Dye content 97 %
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-[2-[2-Chloro-3-[(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethylindolium iodide
Technique Mull
Wiley ID SIAL_FTIR_1_8085