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3-amino-4,5-diphenyl-4H-1,2,4-triazole
SpectraBase Compound ID Dd0tUZOCJd0
InChI InChI=1S/C14H12N4/c15-14-17-16-13(11-7-3-1-4-8-11)18(14)12-9-5-2-6-10-12/h1-10H,(H2,15,17)
InChIKey RZPWNIHAJGIKJB-UHFFFAOYSA-N
Mol Weight 236.28 g/mol
Molecular Formula C14H12N4
Exact Mass 236.106196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5F2RKEcg6S
Name 4H-1,2,4-Triazol-3-amine, 4,5-diphenyl-
CAS Registry Number 27878-15-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4
InChI InChI=1S/C14H12N4/c15-14-17-16-13(11-7-3-1-4-8-11)18(14)12-9-5-2-6-10-12/h1-10H,(H2,15,17)
InChIKey RZPWNIHAJGIKJB-UHFFFAOYSA-N
Molecular Weight 236.278 g/mol
SMILES Nc1[n](c(nn1)-c1ccccc1)-c1ccccc1
SPLASH splash10-000i-9560000000-11a8ee4e91b161023c43
Source of Spectrum B-28-2090-1
Synonyms 3-Amino-4,5-diphenyl-4H-1,2,4-triazole 4,5-Diphenyl-4H-1,2,4-triazol-3-amine 4,5-Diphenyl-4H-1,2,4-triazol-3-ylamine 4H-1,2,4-triazole, 3-amino-4,5-diphenyl- 4,5-Diphenyl-1,2,4-triazol-3-amine
Wiley ID 1238242