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]+ 249.045896 150.4
[M+Na]+ 271.027838 159.4
[M-H]- 247.031344 156.2
[M+NH4]+ 266.072443 169.5
[M+K]+ 287.001778 156.0
[M+H-H2O]+ 231.035880 145.2
[M+HCOO]- 293.036821 166.7
[M+CH3COO]- 307.052471 197.2
[M+Na-2H]- 269.013286 154.4
[M]+ 248.03807142 155.8
[M]- 248.03916858 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.