For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3-DIISOPROPYL-2-(METHYLTHIO)-5-(4-NITROPHENYL)-4-(ISOPROPYLAMINO)-IMIDAZOLIUM-CHLORIDE
SpectraBase Compound ID 1PNNZfPBakw
InChI InChI=1S/C19H29N4O2S.ClH/c1-12(2)20-18-17(15-8-10-16(11-9-15)23(24)25)21(13(3)4)19(26-7)22(18)14(5)6;/h8-14,20H,1-7H3;1H/q+1;/p-1
InChIKey FUJAOTBIEDUPTM-UHFFFAOYSA-M
Mol Weight 412.98 g/mol
Molecular Formula C19H29ClN4O2S
Exact Mass 412.169975 g/mol
Parent InChIKey PRHNCEVEJSOHPC-UHFFFAOYSA-M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Three-component cyclocondensations. An efficient synthesis of 4-amino-2-(methylthio)imidazolium salts via the reaction of methyl chlorothioimidates with benzaldimines and isocyanides. Autoxidation of the imidazole derivatives The Journal of Organic Chemistry 1992

This compound is available in the following databases:

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.