CID 43700352

2-chloro-n-(2-methyl-5-sulfamoylphenyl)acetamide

Structural Information

Molecular Formula
C9H11ClN2O3S
SMILES
CC1=C(C=C(C=C1)S(=O)(=O)N)NC(=O)CCl
InChI
InChI=1S/C9H11ClN2O3S/c1-6-2-3-7(16(11,14)15)4-8(6)12-9(13)5-10/h2-4H,5H2,1H3,(H,12,13)(H2,11,14,15)
InChIKey
QTAGIXPSSLCDJA-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-methyl-5-sulfamoylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.01788 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.02516 153.2
[M+Na]+ 285.00710 161.9
[M-H]- 261.01060 157.0
[M+NH4]+ 280.05170 170.6
[M+K]+ 300.98104 157.1
[M+H-H2O]+ 245.01514 148.2
[M+HCOO]- 307.01608 167.8
[M+CH3COO]- 321.03173 194.7
[M+Na-2H]- 282.99255 155.9
[M]+ 262.01733 156.3
[M]- 262.01843 156.3
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

No patent data available for this compound.