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3H-1,2,4-Triazol-3-one, 4-amino-2,4-dihydro-5-phenyl-
SpectraBase Compound ID A1XJW4V5XY5
InChI InChI=1S/C8H8N4O/c9-12-7(10-11-8(12)13)6-4-2-1-3-5-6/h1-5H,9H2,(H,11,13)
InChIKey OVCWQZAMXXYERB-UHFFFAOYSA-N
Mol Weight 176.18 g/mol
Molecular Formula C8H8N4O
Exact Mass 176.069811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9TaqbsH0jv
Name 3H-1,2,4-Triazol-3-one, 4-amino-2,4-dihydro-5-phenyl-
CAS Registry Number 57735-10-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N4O
InChI InChI=1S/C8H8N4O/c9-12-7(10-11-8(12)13)6-4-2-1-3-5-6/h1-5H,9H2,(H,11,13)
InChIKey OVCWQZAMXXYERB-UHFFFAOYSA-N
Molecular Weight 176.179 g/mol
SMILES N1N=C(N(C1=O)N)c1ccccc1
SPLASH splash10-0fb9-7900000000-8108e8a6e117e885ba98
Source of Spectrum O-14-376-4
Synonyms 4-Amino-5-phenyl-4,5-dihydro-3H-1,2,4-triazol-3-one 3-Phenyl-4-amino-4,5(3H)-dihydro-1,2,4-triazole-5-one 4-Amino-3-phenyl-3H-1,2,4-triazol-5-one 4-Azanyl-3-phenyl-3H-1,2,4-triazol-5-one
Wiley ID 1172000