CID 167723004

N-(4-chloro-2-hydroxyphenyl)ethene-1-sulfonamide

Structural Information

Molecular Formula
C8H8ClNO3S
SMILES
C=CS(=O)(=O)NC1=C(C=C(C=C1)Cl)O
InChI
InChI=1S/C8H8ClNO3S/c1-2-14(12,13)10-7-4-3-6(9)5-8(7)11/h2-5,10-11H,1H2
InChIKey
CEKADLOJCHFHRS-UHFFFAOYSA-N
Compound name
N-(4-chloro-2-hydroxyphenyl)ethenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.99135 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.99863 144.2
[M+Na]+ 255.98057 154.0
[M-H]- 231.98407 147.4
[M+NH4]+ 251.02517 162.7
[M+K]+ 271.95451 148.5
[M+H-H2O]+ 215.98861 140.0
[M+HCOO]- 277.98955 158.3
[M+CH3COO]- 292.00520 184.5
[M+Na-2H]- 253.96602 148.6
[M]+ 232.99080 147.5
[M]- 232.99190 147.5
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.