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5-phenyl-3H-1,3,4-oxadiazole-2-thione

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 MS (GC)

5-phenyl-3H-1,3,4-oxadiazole-2-thione
SpectraBase Compound ID 8ksCAosr1z1
InChI InChI=1S/C8H6N2OS/c12-8-10-9-7(11-8)6-4-2-1-3-5-6/h1-5H,(H,10,12)
InChIKey FOHWXVBZGSVUGO-UHFFFAOYSA-N
Mol Weight 178.21 g/mol
Molecular Formula C8H6N2OS
Exact Mass 178.020084 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LlBqjuWijJP
Name 5-Phenyl-1,3,4-oxadiazole-2-thiol
Source of Sample Aldrich
Catalog Number 391808
CAS Registry Number 3004-42-0
Classification 5-membered aromatic heterocycles
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2OS
InChI InChI=1S/C8H6N2OS/c12-8-10-9-7(11-8)6-4-2-1-3-5-6/h1-5H,(H,10,12)
InChIKey FOHWXVBZGSVUGO-UHFFFAOYSA-N
Purity 97%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Mull
Wiley ID SIAL_FTIR_1_7597