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3-Phenyl-1,2,4-oxadiazole-5-thiol

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

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6k9m7dOjaf4
Name 3-Phenyl-1,2,4-oxadiazole-5-thiol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 394025
CAS Registry Number 23152-97-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2OS
InChI InChI=1S/C8H6N2OS/c12-8-9-7(10-11-8)6-4-2-1-3-5-6/h1-5H,(H,9,10,12)
InChIKey KLUJJBZDBBYZEJ-UHFFFAOYSA-N
Observed nucleus 13C
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 5-mercapto-3-phenyl-1,2,4-oxadiazole
Wiley ID SIAL_13CNMR_008691