CID 205923

4-amino-3-chloro-n,n-dimethylbenzenesulfonamide

Structural Information

Molecular Formula
C8H11ClN2O2S
SMILES
CN(C)S(=O)(=O)C1=CC(=C(C=C1)N)Cl
InChI
InChI=1S/C8H11ClN2O2S/c1-11(2)14(12,13)6-3-4-8(10)7(9)5-6/h3-5H,10H2,1-2H3
InChIKey
DQGWARKSLZMCJF-UHFFFAOYSA-N
Compound name
4-amino-3-chloro-N,N-dimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

234.02298 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.03026 146.3
[M+Na]+ 257.01220 155.7
[M-H]- 233.01570 151.8
[M+NH4]+ 252.05680 165.7
[M+K]+ 272.98614 152.1
[M+H-H2O]+ 217.02024 141.3
[M+HCOO]- 279.02118 162.2
[M+CH3COO]- 293.03683 193.5
[M+Na-2H]- 254.99765 149.7
[M]+ 234.02243 150.3
[M]- 234.02353 150.3
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

patents stripe