CID 199762

1h-1,2,4-triazole, 5-(p-sulfamoylphenyl)-

Structural Information

Molecular Formula
C8H8N4O2S
SMILES
C1=CC(=CC=C1C2=NC=NN2)S(=O)(=O)N
InChI
InChI=1S/C8H8N4O2S/c9-15(13,14)7-3-1-6(2-4-7)8-10-5-11-12-8/h1-5H,(H2,9,13,14)(H,10,11,12)
InChIKey
FQAHYLJIQSNCSE-UHFFFAOYSA-N
Compound name
4-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

224.0368 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.04408 145.4
[M+Na]+ 247.02602 156.3
[M+NH4]+ 242.07062 151.6
[M+K]+ 262.99996 152.3
[M-H]- 223.02952 145.9
[M+Na-2H]- 245.01147 151.7
[M]+ 224.03625 147.3
[M]- 224.03735 147.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe