CID 147822

2,5-difluorobenzenesulfonamide

Structural Information

Molecular Formula
C6H5F2NO2S
SMILES
C1=CC(=C(C=C1F)S(=O)(=O)N)F
InChI
InChI=1S/C6H5F2NO2S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H,(H2,9,10,11)
InChIKey
OLMFEUWXDKZGOO-UHFFFAOYSA-N
Compound name
2,5-difluorobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

153
Patents

193.0009 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.00818 131.4
[M+Na]+ 215.99012 141.9
[M-H]- 191.99362 132.9
[M+NH4]+ 211.03472 151.1
[M+K]+ 231.96406 138.4
[M+H-H2O]+ 175.99816 124.4
[M+HCOO]- 237.99910 149.0
[M+CH3COO]- 252.01475 180.7
[M+Na-2H]- 213.97557 135.3
[M]+ 193.00035 129.9
[M]- 193.00145 129.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe