CID 19394

Diapamide

Structural Information

Molecular Formula
C9H11ClN2O3S
SMILES
CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC
InChI
InChI=1S/C9H11ClN2O3S/c1-11-9(13)6-3-4-7(10)8(5-6)16(14,15)12-2/h3-5,12H,1-2H3,(H,11,13)
InChIKey
REQFWARMBJWJAQ-UHFFFAOYSA-N
Compound name
4-chloro-N-methyl-3-(methylsulfamoyl)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

490
Patents

262.01788 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.02516 155.6
[M+Na]+ 285.00710 165.7
[M+NH4]+ 280.05170 162.3
[M+K]+ 300.98104 159.2
[M-H]- 261.01060 156.4
[M+Na-2H]- 282.99255 160.2
[M]+ 262.01733 157.7
[M]- 262.01843 157.7
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