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5-(2-((4-carboxyphenyl)amino)thiazol-4-yl)-6-methylimidazo[2,1-b]thiazol-7-ium bromide
SpectraBase Compound ID 6SAJ0S9rM42
InChI InChI=1S/C16H12N4O2S2.BrH/c1-9-13(20-6-7-23-16(20)17-9)12-8-24-15(19-12)18-11-4-2-10(3-5-11)14(21)22;/h2-8H,1H3,(H,18,19)(H,21,22);1H
InChIKey PTORZDNHNCUPKF-UHFFFAOYSA-N
Mol Weight 437.33 g/mol
Molecular Formula C16H13BrN4O2S2
Exact Mass 435.966331 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8J51jzbzGuY
Name 5-(2-((4-carboxyphenyl)amino)thiazol-4-yl)-6-methylimidazo[2,1-b]thiazol-7-ium bromide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H12N4O2S2.BrH/c1-9-13(20-6-7-23-16(20)17-9)12-8-24-15(19-12)18-11-4-2-10(3-5-11)14(21)22;/h2-8H,1H3,(H,18,19)(H,21,22);1H
InChIKey PTORZDNHNCUPKF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_1639
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/9036245; Labnumber: MIH-2010087