CID 108621

Benzenesulfonamide, 3-((ethylphenylamino)methyl)-n,n-dimethyl-

Structural Information

Molecular Formula
C17H22N2O2S
SMILES
CCN(CC1=CC(=CC=C1)S(=O)(=O)N(C)C)C2=CC=CC=C2
InChI
InChI=1S/C17H22N2O2S/c1-4-19(16-10-6-5-7-11-16)14-15-9-8-12-17(13-15)22(20,21)18(2)3/h5-13H,4,14H2,1-3H3
InChIKey
VBSRQOCTUKZSHQ-UHFFFAOYSA-N
Compound name
3-[(N-ethylanilino)methyl]-N,N-dimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

318.1402 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.147476 174.2
[M+Na]+ 341.129418 179.8
[M-H]- 317.132924 183.3
[M+NH4]+ 336.174023 189.5
[M+K]+ 357.103358 177.2
[M+H-H2O]+ 301.137460 165.5
[M+HCOO]- 363.138401 194.5
[M+CH3COO]- 377.154051 215.3
[M+Na-2H]- 339.114866 177.6
[M]+ 318.13965142 178.9
[M]- 318.14074858 178.9
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

patents stripe