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5-{[(4-bromophenyl)sulfanyl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID B1tLvIC4zD3
InChI InChI=1S/C9H8BrN3S2/c10-6-1-3-7(4-2-6)15-5-8-11-9(14)13-12-8/h1-4H,5H2,(H2,11,12,13,14)
InChIKey XQGULXLZERLSPA-UHFFFAOYSA-N
Mol Weight 302.21 g/mol
Molecular Formula C9H8BrN3S2
Exact Mass 300.934303 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID tc4hIrqy9c
Name 5-{[(4-bromophenyl)sulfanyl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione
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/C9H8BrN3S2/c10-6-1-3-7(4-2-6)15-5-8-11-9(14)13-12-8/h1-4H,5H2,(H2,11,12,13,14)
InChIKey XQGULXLZERLSPA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1187
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/9213778; Labnumber: AI-S000342
Temperature 303 °C