CID 79279

N-ethylbenzenesulfonamide

Structural Information

Molecular Formula
C8H11NO2S
SMILES
CCNS(=O)(=O)C1=CC=CC=C1
InChI
InChI=1S/C8H11NO2S/c1-2-9-12(10,11)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3
InChIKey
WNSXUAGCWVZDQC-UHFFFAOYSA-N
Compound name
N-ethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2064
Patents

185.05106 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.05834 136.5
[M+Na]+ 208.04028 144.5
[M-H]- 184.04378 140.5
[M+NH4]+ 203.08488 156.5
[M+K]+ 224.01422 141.7
[M+H-H2O]+ 168.04832 130.8
[M+HCOO]- 230.04926 156.3
[M+CH3COO]- 244.06491 179.6
[M+Na-2H]- 206.02573 142.9
[M]+ 185.05051 138.3
[M]- 185.05161 138.3
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

patents stripe