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4-{[(E)-(4-bromo-2-thienyl)methylidene]amino}-5-ethyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID DAm0v2fQCjV
InChI InChI=1S/C9H9BrN4S2/c1-2-8-12-13-9(15)14(8)11-4-7-3-6(10)5-16-7/h3-5H,2H2,1H3,(H,13,15)/b11-4+
InChIKey QMZDXBFYKMRQRV-NYYWCZLTSA-N
Mol Weight 317.22 g/mol
Molecular Formula C9H9BrN4S2
Exact Mass 315.945202 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3J5LgJimB6P
Name 4-{[(E)-(4-bromo-2-thienyl)methylidene]amino}-5-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/C9H9BrN4S2/c1-2-8-12-13-9(15)14(8)11-4-7-3-6(10)5-16-7/h3-5H,2H2,1H3,(H,13,15)/b11-4+
InChIKey QMZDXBFYKMRQRV-NYYWCZLTSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31148
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: 1736388; SBI_ID: SBI-031152
Synonyms 4-{[(E)-(4-bromo-2-thienyl)methylidene]amino}-5-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(4-bromo-2-thienyl)methylidene]amino}-5-ethyl-4H-1,2,4-triazole-3-thiol
Temperature 306 °C