CID 43212846

4-bromo-2-chloro-n-ethylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C8H9BrClNO2S
SMILES
CCNS(=O)(=O)C1=C(C=C(C=C1)Br)Cl
InChI
InChI=1S/C8H9BrClNO2S/c1-2-11-14(12,13)8-4-3-6(9)5-7(8)10/h3-5,11H,2H2,1H3
InChIKey
WRWIUMLBWFARTJ-UHFFFAOYSA-N
Compound name
4-bromo-2-chloro-N-ethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.92258 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.92986 143.4
[M+Na]+ 319.91180 157.2
[M-H]- 295.91530 150.6
[M+NH4]+ 314.95640 164.1
[M+K]+ 335.88574 143.2
[M+H-H2O]+ 279.91984 144.5
[M+HCOO]- 341.92078 156.6
[M+CH3COO]- 355.93643 195.4
[M+Na-2H]- 317.89725 150.1
[M]+ 296.92203 166.2
[M]- 296.92313 166.2
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.