CID 117747

26175-68-8

Structural Information

Molecular Formula

C₈H₁₀Cl₂N₂O₂S

SMILES

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

InChI

InChI=1S/C8H10Cl2N2O2S/c1-12(2)15(13,14)8-4-5(9)7(11)3-6(8)10/h3-4H,11H2,1-2H3

InChIKey

RVDTXDMZBHZDCD-UHFFFAOYSA-N

Compound name

4-amino-2,5-dichloro-N,N-dimethylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 92
Patents: 267.984 Da
Monoisotopic Mass: 1.6
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]+	268.99128	152.2
[M+Na]+	290.97322	162.5
[M-H]-	266.97672	157.4
[M+NH4]+	286.01782	170.8
[M+K]+	306.94716	157.8
[M+H-H2O]+	250.98126	148.5
[M+HCOO]-	312.98220	163.1
[M+CH3COO]-	326.99785	199.2
[M+Na-2H]-	288.95867	154.2
[M]+	267.98345	157.5
[M]-	267.98455	157.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe