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4-Amino-5-(4-chlorophenyl)-4,5-dihydro-3H-1,2,4-triazol-3-one
SpectraBase Compound ID 1fqrFQGl06G
InChI InChI=1S/C8H7ClN4O/c9-6-3-1-5(2-4-6)7-11-12-8(14)13(7)10/h1-4,7H,10H2
InChIKey PZTHPTHNUPWCOF-UHFFFAOYSA-N
Mol Weight 210.62 g/mol
Molecular Formula C8H7ClN4O
Exact Mass 210.030839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJYbLlmDX88
Name 4-Amino-5-(4-chlorophenyl)-4,5-dihydro-3H-1,2,4-triazol-3-one
CAS Registry Number 70249-90-0
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClN4O
InChI InChI=1S/C8H7ClN4O/c9-6-3-1-5(2-4-6)7-11-12-8(14)13(7)10/h1-4,7H,10H2
InChIKey PZTHPTHNUPWCOF-UHFFFAOYSA-N
Molecular Weight 210.624 g/mol
SMILES NN1C(N=NC1c1ccc(cc1)Cl)=O
SPLASH splash10-03di-3950000000-a1d7cabbeacfb6e51bbc
Source of Spectrum O-14-376-4
Wiley ID 1208570