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3-(4-(piperidin-1-ylsulfonyl)phenyl)-5,6-dihydroimidazo[2,1-b]thiazol-7-ium bromide
SpectraBase Compound ID Hf5VYGretxE
InChI InChI=1S/C16H19N3O2S2.BrH/c20-23(21,18-9-2-1-3-10-18)14-6-4-13(5-7-14)15-12-22-16-17-8-11-19(15)16;/h4-7,12H,1-3,8-11H2;1H
InChIKey GCJMUALBJAUOLG-UHFFFAOYSA-N
Mol Weight 430.38 g/mol
Molecular Formula C16H20BrN3O2S2
Exact Mass 429.018032 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JCGfrqhE13m
Name 3-(4-(piperidin-1-ylsulfonyl)phenyl)-5,6-dihydroimidazo[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/C16H19N3O2S2.BrH/c20-23(21,18-9-2-1-3-10-18)14-6-4-13(5-7-14)15-12-22-16-17-8-11-19(15)16;/h4-7,12H,1-3,8-11H2;1H
InChIKey GCJMUALBJAUOLG-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5678
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: NMR/10210571