CID 284730

4-[4-(ethylamino)phenyl]sulfonylaniline

Structural Information

Molecular Formula
C14H16N2O2S
SMILES
CCNC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C14H16N2O2S/c1-2-16-12-5-9-14(10-6-12)19(17,18)13-7-3-11(15)4-8-13/h3-10,16H,2,15H2,1H3
InChIKey
JQVXSWNILDNAJT-UHFFFAOYSA-N
Compound name
4-[4-(ethylamino)phenyl]sulfonylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

276.09326 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.10054 160.9
[M+Na]+ 299.08248 168.5
[M-H]- 275.08598 167.4
[M+NH4]+ 294.12708 176.6
[M+K]+ 315.05642 163.3
[M+H-H2O]+ 259.09052 153.4
[M+HCOO]- 321.09146 180.6
[M+CH3COO]- 335.10711 200.3
[M+Na-2H]- 297.06793 165.3
[M]+ 276.09271 161.4
[M]- 276.09381 161.4
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.