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1,3,5-TRIS-[(3-METHYLIMIDAZOL-3-IUMYL)-METHYL]-BENZENE-TRIBROMIDE
SpectraBase Compound ID Ccx92vjvdUf
InChI InChI=1S/C21H27N6.3BrH/c1-22-4-7-25(16-22)13-19-10-20(14-26-8-5-23(2)17-26)12-21(11-19)15-27-9-6-24(3)18-27;;;/h4-12,16-18H,13-15H2,1-3H3;3*1H/q+3;;;/p-3
InChIKey VSVRHAXWSIFOSC-UHFFFAOYSA-K
Mol Weight 603.201 g/mol
Molecular Formula C21H27Br3N6
Exact Mass 599.984734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59skrJQxi2z
Name 1,3,5-TRIS-[(3-METHYLIMIDAZOL-3-IUMYL)-METHYL]-BENZENE-TRIBROMIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27Br3N6
InChI InChI=1S/C21H27N6.3BrH/c1-22-4-7-25(16-22)13-19-10-20(14-26-8-5-23(2)17-26)12-21(11-19)15-27-9-6-24(3)18-27;;;/h4-12,16-18H,13-15H2,1-3H3;3*1H/q+3;;;/p-3
InChIKey VSVRHAXWSIFOSC-UHFFFAOYSA-K
Literature Reference Author T.FAHLBUSCH,M.FRANK,J.SCHATZ,H.SCHMADERER
Literature Reference Citation EUR.J.ORG.CHEM.,1899(2006)
Molecular Weight 603.198 g/mol
Sample ID 31917
Solvent CD3OD