CID 35767306

[(2-chloro-4-methylphenyl)sulfamoyl]dimethylamine

Structural Information

Molecular Formula
C9H13ClN2O2S
SMILES
CC1=CC(=C(C=C1)NS(=O)(=O)N(C)C)Cl
InChI
InChI=1S/C9H13ClN2O2S/c1-7-4-5-9(8(10)6-7)11-15(13,14)12(2)3/h4-6,11H,1-3H3
InChIKey
HHCSIMQMKVEQNT-UHFFFAOYSA-N
Compound name
2-chloro-1-(dimethylsulfamoylamino)-4-methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.03862 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.04590 150.4
[M+Na]+ 271.02784 159.4
[M-H]- 247.03134 156.2
[M+NH4]+ 266.07244 169.5
[M+K]+ 287.00178 156.0
[M+H-H2O]+ 231.03588 145.2
[M+HCOO]- 293.03682 166.7
[M+CH3COO]- 307.05247 197.2
[M+Na-2H]- 269.01329 154.4
[M]+ 248.03807 155.8
[M]- 248.03917 155.8
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.