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5-(1-benzothien-3-yl)-4-methyl-4H-1,2,4-triazole-3-thiol

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5-(1-benzothien-3-yl)-4-methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID LTYeZqFevqF
InChI InChI=1S/C11H9N3S2/c1-14-10(12-13-11(14)15)8-6-16-9-5-3-2-4-7(8)9/h2-6H,1H3,(H,13,15)
InChIKey HYAGAYJNXSBVSP-UHFFFAOYSA-N
Mol Weight 247.33 g/mol
Molecular Formula C11H9N3S2
Exact Mass 247.02379 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Apx6TfpXISU
Name 5-(1-benzothien-3-yl)-4-methyl-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/C11H9N3S2/c1-14-10(12-13-11(14)15)8-6-16-9-5-3-2-4-7(8)9/h2-6H,1H3,(H,13,15)
InChIKey HYAGAYJNXSBVSP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6758
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/1266319; Labnumber: COL3374; UZI_ID: UZI-006760
Synonyms 5-(1-benzothien-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C