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5-(4-bromobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol

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5-(4-bromobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID FVlmBqFg41Y
InChI InChI=1S/C11H12BrN3S/c1-2-15-10(13-14-11(15)16)7-8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H,14,16)
InChIKey RPXRJWPJVQMAEO-UHFFFAOYSA-N
Mol Weight 298.2 g/mol
Molecular Formula C11H12BrN3S
Exact Mass 296.993532 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CQwhJF9n22H
Name 5-(4-bromobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
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/C11H12BrN3S/c1-2-15-10(13-14-11(15)16)7-8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H,14,16)
InChIKey RPXRJWPJVQMAEO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7085
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: UZI/1266537; Labnumber: COL4132; UZI_ID: UZI-007087
Synonyms 5-(4-bromobenzyl)-4-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C