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1H-1,2,4-Triazolium, 2,3-dihydro-5-hydroxy-1,1-dimethyl-3-oxo-2-phenyl-, hydroxide, inner salt
SpectraBase Compound ID 2G641bKN14a
InChI InChI=1S/C10H11N3O2/c1-13(2)10(15)11-9(14)12(13)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKey CMUASFDKYSALCE-UHFFFAOYSA-N
Mol Weight 205.22 g/mol
Molecular Formula C10H11N3O2
Exact Mass 205.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CVZvfGK0qX
Name 1H-1,2,4-Triazolium, 2,3-dihydro-5-hydroxy-1,1-dimethyl-3-oxo-2-phenyl-, hydroxide, inner salt
CAS Registry Number 90195-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O2
InChI InChI=1S/C10H11N3O2/c1-13(2)10(15)11-9(14)12(13)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKey CMUASFDKYSALCE-UHFFFAOYSA-N
Molecular Weight 205.217 g/mol
SMILES C1(N=C([N+](N1c1ccccc1)(C)C)[O-])=O
SPLASH splash10-0a6r-9370000000-2cf7d8eb3883f20f654a
Source of Spectrum J-49-2407-0
Synonyms 1,1-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-1,2,4-triazol-1-ium-5-olate Anhydro-1,1-dimethyl-3-hydroxy-5-oxo-2-phenyl-1,2,4-triazolinium hydroxide
Wiley ID 1203263