CID 69033

N-hydroxybenzenesulfonamide

Structural Information

Molecular Formula
C6H7NO3S
SMILES
C1=CC=C(C=C1)S(=O)(=O)NO
InChI
InChI=1S/C6H7NO3S/c8-7-11(9,10)6-4-2-1-3-5-6/h1-5,7-8H
InChIKey
BRMDATNYMUMZLN-UHFFFAOYSA-N
Compound name
N-hydroxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

23
References

661
Patents

173.01466 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.02194 131.2
[M+Na]+ 196.00388 139.3
[M-H]- 172.00738 133.9
[M+NH4]+ 191.04848 150.7
[M+K]+ 211.97782 136.6
[M+H-H2O]+ 156.01192 125.8
[M+HCOO]- 218.01286 150.3
[M+CH3COO]- 232.02851 173.1
[M+Na-2H]- 193.98933 138.2
[M]+ 173.01411 131.8
[M]- 173.01521 131.8
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