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7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazinium, 6-(4-chlorophenyl)-3-(1-methylethyl)-, bromide
SpectraBase Compound ID CGCcikyhZDh
InChI InChI=1S/C13H13ClN4S.BrH/c1-8(2)12-15-16-13-18(12)17-11(7-19-13)9-3-5-10(14)6-4-9;/h3-6,8H,7H2,1-2H3;1H
InChIKey AZWRLJQCPGHTQM-UHFFFAOYSA-N
Mol Weight 373.7 g/mol
Molecular Formula C13H14BrClN4S
Exact Mass 371.981108 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 94ob4eHt6Xp
Name 7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazinium, 6-(4-chlorophenyl)-3-(1-methylethyl)-, 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/C13H13ClN4S.BrH/c1-8(2)12-15-16-13-18(12)17-11(7-19-13)9-3-5-10(14)6-4-9;/h3-6,8H,7H2,1-2H3;1H
InChIKey AZWRLJQCPGHTQM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5661
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/18217088