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4-(4-phenoxyphenyl)-5-(2-thienyl)-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(4-phenoxyphenyl)-5-(2-thienyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID F8GLr4d6yEU
InChI InChI=1S/C18H13N3OS2/c23-18-20-19-17(16-7-4-12-24-16)21(18)13-8-10-15(11-9-13)22-14-5-2-1-3-6-14/h1-12H,(H,20,23)
InChIKey UCDQWMOHVXQLRG-UHFFFAOYSA-N
Mol Weight 351.44 g/mol
Molecular Formula C18H13N3OS2
Exact Mass 351.050004 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3zxceoIspTk
Name 4-(4-phenoxyphenyl)-5-(2-thienyl)-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/C18H13N3OS2/c23-18-20-19-17(16-7-4-12-24-16)21(18)13-8-10-15(11-9-13)22-14-5-2-1-3-6-14/h1-12H,(H,20,23)
InChIKey UCDQWMOHVXQLRG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18028
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: D31629; Labnumber: VGU-0022017; SBI_ID: SBI-018031
Synonyms 4-(4-phenoxyphenyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C