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7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazinium, 3-(1-methylethyl)-6-phenyl-, bromide
SpectraBase Compound ID 2W6esxVSlHW
InChI InChI=1S/C13H14N4S.BrH/c1-9(2)12-14-15-13-17(12)16-11(8-18-13)10-6-4-3-5-7-10;/h3-7,9H,8H2,1-2H3;1H
InChIKey SWQPXDLEVMMCOP-UHFFFAOYSA-N
Mol Weight 339.25 g/mol
Molecular Formula C13H15BrN4S
Exact Mass 338.020081 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6BU0LCGV772
Name 7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazinium, 3-(1-methylethyl)-6-phenyl-, 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/C13H14N4S.BrH/c1-9(2)12-14-15-13-17(12)16-11(8-18-13)10-6-4-3-5-7-10;/h3-7,9H,8H2,1-2H3;1H
InChIKey SWQPXDLEVMMCOP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5660
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/18217087