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1H-1,2,4-Triazolium, 3-hydroxy-4,5-dimethyl-1-phenyl-, hydroxide, inner salt
SpectraBase Compound ID EhWNwpzfhOK
InChI InChI=1S/C10H11N3O/c1-8-12(2)10(14)11-13(8)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey LQEQFVWEABHPFV-UHFFFAOYSA-N
Mol Weight 189.22 g/mol
Molecular Formula C10H11N3O
Exact Mass 189.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FqcE0dSJJV8
Name 1H-1,2,4-Triazolium, 3-hydroxy-4,5-dimethyl-1-phenyl-, hydroxide, inner salt
CAS Registry Number 40727-00-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O
InChI InChI=1S/C10H11N3O/c1-8-12(2)10(14)11-13(8)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey LQEQFVWEABHPFV-UHFFFAOYSA-N
Molecular Weight 189.218 g/mol
SMILES c1(n[n+](c([n]1C)C)-c1ccccc1)[O-]
SPLASH splash10-0a4r-9500000000-b901e8cd25552768ac33
Source of Spectrum O7-0-203-0
Synonyms 3-Hydroxy-4,5-dimethyl-1-phenyl-4H-1,2,4-triazolium hydroxide, inner salt 4,5-Dimethyl-1-phenyl-4H-1,2,4-triazol-1-ium-3-olate Anhydro-4,5-dimethyl-3-hydroxy-1-phenyl-1,2,4-triazolium hydroxide
Wiley ID 1185570