CID 2758059

2,6-dichlorobenzenesulfonamide

Structural Information

Molecular Formula

C₆H₅Cl₂NO₂S

SMILES

C1=CC(=C(C(=C1)Cl)S(=O)(=O)N)Cl

InChI

InChI=1S/C6H5Cl2NO2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H,(H2,9,10,11)

InChIKey

RAJHEZQFXIHNNL-UHFFFAOYSA-N

Compound name

2,6-dichlorobenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 137
Patents: 224.9418 Da
Monoisotopic Mass: 1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	225.949076	139.2
[M+Na]+	247.931018	150.4
[M-H]-	223.934524	143.1
[M+NH4]+	242.975623	159.0
[M+K]+	263.904958	144.8
[M+H-H2O]+	207.939060	136.2
[M+HCOO]-	269.940001	149.3
[M+CH3COO]-	283.955651	183.9
[M+Na-2H]-	245.916466	143.0
[M]+	224.94125142	142.8
[M]-	224.94234858	142.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe