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1,3,5-TRIIMIDAZOLYLBENZENE

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1,3,5-TRIIMIDAZOLYLBENZENE
SpectraBase Compound ID 3XYy2HG9I3g
InChI InChI=1S/C27H18N6/c1-2-8-20-19(7-1)28-25(29-20)16-13-17(26-30-21-9-3-4-10-22(21)31-26)15-18(14-16)27-32-23-11-5-6-12-24(23)33-27/h1-15H,(H,28,29)(H,30,31)(H,32,33)
InChIKey GEJNKGHTWHDVTK-UHFFFAOYSA-N
Mol Weight 426.48 g/mol
Molecular Formula C27H18N6
Exact Mass 426.159295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdeE2b4SCy
Name 1,3,5-TRIIMIDAZOLYLBENZENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H18N6
InChI InChI=1S/C27H18N6/c1-2-8-20-19(7-1)28-25(29-20)16-13-17(26-30-21-9-3-4-10-22(21)31-26)15-18(14-16)27-32-23-11-5-6-12-24(23)33-27/h1-15H,(H,28,29)(H,30,31)(H,32,33)
InChIKey GEJNKGHTWHDVTK-UHFFFAOYSA-N
Literature Reference Author B.ZHANG,Y.GAO,J.L.LI,Z.SHI
Literature Reference Citation CHIN.CHEM.LETT.,17,1165(2006)
Molecular Weight 426.480 g/mol
Sample ID 46446
Solvent DMSO-D6