CID 710432

4-chloro-n-(2-ethoxyphenyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C14H14ClNO3S
SMILES
CCOC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H14ClNO3S/c1-2-19-14-6-4-3-5-13(14)16-20(17,18)12-9-7-11(15)8-10-12/h3-10,16H,2H2,1H3
InChIKey
OEKWWENFBRJUAM-UHFFFAOYSA-N
Compound name
4-chloro-N-(2-ethoxyphenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

311.0383 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.04558 166.5
[M+Na]+ 334.02752 175.6
[M-H]- 310.03102 173.8
[M+NH4]+ 329.07212 182.4
[M+K]+ 350.00146 169.9
[M+H-H2O]+ 294.03556 160.1
[M+HCOO]- 356.03650 181.7
[M+CH3COO]- 370.05215 201.6
[M+Na-2H]- 332.01297 171.2
[M]+ 311.03775 172.3
[M]- 311.03885 172.3
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

No patent data available for this compound.