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1,2,3,4-Thiatriazole, 5-phenyl-, 3-oxide
SpectraBase Compound ID 3ez9jM2Svhy
InChI InChI=1S/C7H5N3OS/c11-10-8-7(12-9-10)6-4-2-1-3-5-6/h1-5H
InChIKey SHQYHMDCHAHFSJ-UHFFFAOYSA-N
Mol Weight 179.2 g/mol
Molecular Formula C7H5N3OS
Exact Mass 179.015333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhMmlprrSIy
Name 1,2,3,4-Thiatriazole, 5-phenyl-, 3-oxide
CAS Registry Number 57529-16-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5N3OS
InChI InChI=1S/C7H5N3OS/c11-10-8-7(12-9-10)6-4-2-1-3-5-6/h1-5H
InChIKey SHQYHMDCHAHFSJ-UHFFFAOYSA-N
Molecular Weight 179.197 g/mol
SMILES c1ccc(cc1)-c1n[n+](ns1)[O-]
SPLASH splash10-0fc1-9500000000-1f23b5d70e05b465fa38
Source of Spectrum W5-12149-0-0
Synonyms 5-Phenyl-1,2,3,4-thiatriazole 3-oxide 3-Oxidanidyl-5-phenyl-1,2,3,4-thiatriazol-3-ium 3-Oxido-5-phenyl-thiatriazol-3-ium
Wiley ID 1175002