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3-Phenyl-1,2,3-oxadiazol-3-ium-5-thiolate
SpectraBase Compound ID 9RF15RL6l7J
InChI InChI=1S/C8H6N2OS/c12-8-6-10(9-11-8)7-4-2-1-3-5-7/h1-6H
InChIKey KXNAEWAALYCLTQ-UHFFFAOYSA-N
Mol Weight 178.21 g/mol
Molecular Formula C8H6N2OS
Exact Mass 178.020084 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0UkmSeyF2L
Name 3-Phenyl-1,2,3-oxadiazol-3-ium-5-thiolate
CAS Registry Number 56666-77-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2OS
InChI InChI=1S/C8H6N2OS/c12-8-6-10(9-11-8)7-4-2-1-3-5-7/h1-6H
InChIKey KXNAEWAALYCLTQ-UHFFFAOYSA-N
Molecular Weight 178.209 g/mol
SMILES c1ccc(cc1)-[n+]1cc(on1)[S-]
SPLASH splash10-00dj-9000000000-44ded55f3ff7bbbce59a
Source of Spectrum W5-1989-37121-28415
Synonyms 3-Phenyl-5-oxadiazol-3-iumthiolate 3-Phenyloxadiazol-3-ium-5-thiolate
Wiley ID 1173681