CID 235511

5-amino-2-methylbenzenesulfonamide

Structural Information

Molecular Formula
C7H10N2O2S
SMILES
CC1=C(C=C(C=C1)N)S(=O)(=O)N
InChI
InChI=1S/C7H10N2O2S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,8H2,1H3,(H2,9,10,11)
InChIKey
KTPBKMYOIFHJMI-UHFFFAOYSA-N
Compound name
5-amino-2-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

334
Patents

186.0463 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.05358 137.5
[M+Na]+ 209.03552 147.5
[M+NH4]+ 204.08012 145.0
[M+K]+ 225.00946 141.6
[M-H]- 185.03902 139.2
[M+Na-2H]- 207.02097 142.6
[M]+ 186.04575 139.6
[M]- 186.04685 139.6
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