CID 10081163

N-hydroxy-4-methylbenzenesulfonamide

Structural Information

Molecular Formula
C7H9NO3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NO
InChI
InChI=1S/C7H9NO3S/c1-6-2-4-7(5-3-6)12(10,11)8-9/h2-5,8-9H,1H3
InChIKey
XMJJPCJUQLGGND-UHFFFAOYSA-N
Compound name
N-hydroxy-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

164
Patents

187.03032 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.03760 135.2
[M+Na]+ 210.01954 143.8
[M-H]- 186.02304 138.2
[M+NH4]+ 205.06414 154.5
[M+K]+ 225.99348 140.9
[M+H-H2O]+ 170.02758 129.9
[M+HCOO]- 232.02852 154.0
[M+CH3COO]- 246.04417 177.3
[M+Na-2H]- 208.00499 141.1
[M]+ 187.02977 136.6
[M]- 187.03087 136.6
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