CID 10353728

N,n-dimethyl-4-sulfamoylbenzamide

Structural Information

Molecular Formula
C9H12N2O3S
SMILES
CN(C)C(=O)C1=CC=C(C=C1)S(=O)(=O)N
InChI
InChI=1S/C9H12N2O3S/c1-11(2)9(12)7-3-5-8(6-4-7)15(10,13)14/h3-6H,1-2H3,(H2,10,13,14)
InChIKey
PATCOXOSYWGZRL-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-sulfamoylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

70
Patents

228.05687 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.064146 147.1
[M+Na]+ 251.046088 154.5
[M-H]- 227.049594 152.1
[M+NH4]+ 246.090693 165.3
[M+K]+ 267.020028 152.9
[M+H-H2O]+ 211.054130 140.6
[M+HCOO]- 273.055071 166.6
[M+CH3COO]- 287.070721 193.0
[M+Na-2H]- 249.031536 150.2
[M]+ 228.05632142 149.1
[M]- 228.05741858 149.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe