CID 3051967

Gs 430

Structural Information

Molecular Formula
C10H13ClN2O3S
SMILES
CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N(C)C)Cl
InChI
InChI=1S/C10H13ClN2O3S/c1-7(14)12-10-5-4-8(6-9(10)11)17(15,16)13(2)3/h4-6H,1-3H3,(H,12,14)
InChIKey
UNKYRWICCVJZKG-UHFFFAOYSA-N
Compound name
N-[2-chloro-4-(dimethylsulfamoyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.03354 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.04082 156.7
[M+Na]+ 299.02276 165.1
[M-H]- 275.02626 162.4
[M+NH4]+ 294.06736 174.4
[M+K]+ 314.99670 161.9
[M+H-H2O]+ 259.03080 151.3
[M+HCOO]- 321.03174 172.0
[M+CH3COO]- 335.04739 201.6
[M+Na-2H]- 297.00821 159.4
[M]+ 276.03299 162.5
[M]- 276.03409 162.5
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.