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5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID CsqNUnVqzkl
InChI InChI=1S/C8H6N4O2S/c13-12(14)6-3-1-2-5(4-6)7-9-8(15)11-10-7/h1-4H,(H2,9,10,11,15)
InChIKey HCOKKYWOAPKADT-UHFFFAOYSA-N
Mol Weight 222.22 g/mol
Molecular Formula C8H6N4O2S
Exact Mass 222.021147 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID XJBUoIfLid
Name 5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
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/C8H6N4O2S/c13-12(14)6-3-1-2-5(4-6)7-9-8(15)11-10-7/h1-4H,(H2,9,10,11,15)
InChIKey HCOKKYWOAPKADT-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11079
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: 802297; Labnumber: AEGU7-0179; VK_ID: VK-011083
Synonyms 5-(3-nitrophenyl)-4H-1,2,4-triazole-3-thiol
Temperature 308 °C