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3-PHENYL-5-MERCAPTO-1,2,3,4-OXATRIAZOLE

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3-PHENYL-5-MERCAPTO-1,2,3,4-OXATRIAZOLE
SpectraBase Compound ID 5aEVEUzBnzG
InChI InChI=1S/C7H5N3OS/c12-7-8-10(9-11-7)6-4-2-1-3-5-6/h1-5H
InChIKey XPYDOPYHFDYWON-UHFFFAOYSA-N
Mol Weight 179.2 g/mol
Molecular Formula C7H5N3OS
Exact Mass 179.015333 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1LrWUXBLsar
Name 3-Phenyl-1,2,3,4-oxatriazolium-5-thiolate
CAS Registry Number 60078-11-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H5N3OS
InChI InChI=1S/C7H5N3OS/c12-7-8-10(9-11-7)6-4-2-1-3-5-6/h1-5H
InChIKey XPYDOPYHFDYWON-UHFFFAOYSA-N
Instrument Name Bruker AM-500
Literature Reference J. Jazwinski, L. Stefaniak, G.A.Webb, Magn. Res. Chem. 26, 1012 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3