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5-amino-3-(2-(methylammonio)ethyl)-4H-1,2,4-triazol-1-ium bromide

View entire compound with spectra: 1 NMR

5-amino-3-(2-(methylammonio)ethyl)-4H-1,2,4-triazol-1-ium bromide
SpectraBase Compound ID DVrQHFvL6YW
InChI InChI=1S/C5H12N5.2BrH/c1-7-3-2-4-8-5(6)10-9-4;;/h7,10H,2-3,6H2,1H3,(H,8,9);2*1H/q+1;;/p-1
InChIKey QBIHBBGOEVPMHX-UHFFFAOYSA-M
Mol Weight 303.002 g/mol
Molecular Formula C5H13Br2N5
Exact Mass 300.953771 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1dqBoIJTmO5
Name 5-amino-3-(2-(methylammonio)ethyl)-4H-1,2,4-triazol-1-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/C5H12N5.2BrH/c1-7-3-2-4-8-5(6)10-9-4;;/h7,10H,2-3,6H2,1H3,(H,8,9);2*1H/q+1;;/p-1
InChIKey QBIHBBGOEVPMHX-UHFFFAOYSA-M
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_5207
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: AG-205/4041491; IOH_ID: IOH-012210