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]+ 233.998626 144.2
[M+Na]+ 255.980568 154.0
[M-H]- 231.984074 147.4
[M+NH4]+ 251.025173 162.7
[M+K]+ 271.954508 148.5
[M+H-H2O]+ 215.988610 140.0
[M+HCOO]- 277.989551 158.3
[M+CH3COO]- 292.005201 184.5
[M+Na-2H]- 253.966016 148.6
[M]+ 232.99080142 147.5
[M]- 232.99189858 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.