CID 3704448

3-amino-n-(4-ethoxyphenyl)-4-methoxybenzene-1-sulfonamide

Structural Information

Molecular Formula
C15H18N2O4S
SMILES
CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)N
InChI
InChI=1S/C15H18N2O4S/c1-3-21-12-6-4-11(5-7-12)17-22(18,19)13-8-9-15(20-2)14(16)10-13/h4-10,17H,3,16H2,1-2H3
InChIKey
HPLLPTUQWXUKNF-UHFFFAOYSA-N
Compound name
3-amino-N-(4-ethoxyphenyl)-4-methoxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

322.09872 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.10600 171.7
[M+Na]+ 345.08794 179.2
[M-H]- 321.09144 178.3
[M+NH4]+ 340.13254 185.6
[M+K]+ 361.06188 175.1
[M+H-H2O]+ 305.09598 163.6
[M+HCOO]- 367.09692 191.4
[M+CH3COO]- 381.11257 209.0
[M+Na-2H]- 343.07339 175.5
[M]+ 322.09817 175.7
[M]- 322.09927 175.7
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