CID 2781278

4-amino-n-(2,4-difluorophenyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C12H10F2N2O2S
SMILES
C1=CC(=CC=C1N)S(=O)(=O)NC2=C(C=C(C=C2)F)F
InChI
InChI=1S/C12H10F2N2O2S/c13-8-1-6-12(11(14)7-8)16-19(17,18)10-4-2-9(15)3-5-10/h1-7,16H,15H2
InChIKey
LYWJIXGZACXKRN-UHFFFAOYSA-N
Compound name
4-amino-N-(2,4-difluorophenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.0431 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.05038 157.0
[M+Na]+ 307.03232 166.4
[M-H]- 283.03582 161.3
[M+NH4]+ 302.07692 172.5
[M+K]+ 323.00626 160.7
[M+H-H2O]+ 267.04036 148.0
[M+HCOO]- 329.04130 175.1
[M+CH3COO]- 343.05695 200.9
[M+Na-2H]- 305.01777 160.6
[M]+ 284.04255 155.0
[M]- 284.04365 155.0
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

No patent data available for this compound.