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1-benzyl-2-[(2,3,4,5,6-pentamethyl)benzyl)thio]imidazolium chloride

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1-benzyl-2-[(2,3,4,5,6-pentamethyl)benzyl)thio]imidazolium chloride
SpectraBase Compound ID jPHe81ujEG
InChI InChI=1S/C22H28N2S.ClH/c1-15-16(2)18(4)21(19(5)17(15)3)14-25-22-23-11-12-24(22)13-20-9-7-6-8-10-20;/h6-10H,11-14H2,1-5H3;1H
InChIKey JIZUIOSGNAOPHZ-UHFFFAOYSA-N
Mol Weight 389.0 g/mol
Molecular Formula C22H29ClN2S
Exact Mass 388.173998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LA7BbbGYZKa
Name 1-BENZYL-2-[(2,3,4,5,6-PENTAMETHYLBENZYL)THIO]IMIDAZOLIUM CHLORIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Some carbon atoms are unassigned; Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29ClN2S
InChI InChI=1S/C22H28N2S.ClH/c1-15-16(2)18(4)21(19(5)17(15)3)14-25-22-23-11-12-24(22)13-20-9-7-6-8-10-20;/h6-10H,11-14H2,1-5H3;1H
InChIKey JIZUIOSGNAOPHZ-UHFFFAOYSA-N
Molecular Weight 389.01
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms IMIDAZOLIUM CHLORIDE, 1-BENZYL-2- //2,3,4,5,6-PENTAMETHYLBENZYL/THIO/-,