CID 3833553

735322-12-0

Structural Information

Molecular Formula
C18H22N2O5S
SMILES
CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N
InChI
InChI=1S/C18H22N2O5S/c1-2-24-14-3-5-15(6-4-14)25-18-8-7-16(13-17(18)19)26(21,22)20-9-11-23-12-10-20/h3-8,13H,2,9-12,19H2,1H3
InChIKey
MKDRWCVWOAWEJV-UHFFFAOYSA-N
Compound name
2-(4-ethoxyphenoxy)-5-morpholin-4-ylsulfonylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

378.12494 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.132216 186.4
[M+Na]+ 401.114158 191.8
[M-H]- 377.117664 194.4
[M+NH4]+ 396.158763 194.9
[M+K]+ 417.088098 188.9
[M+H-H2O]+ 361.122200 176.8
[M+HCOO]- 423.123141 199.6
[M+CH3COO]- 437.138791 215.1
[M+Na-2H]- 399.099606 189.1
[M]+ 378.12439142 187.9
[M]- 378.12548858 187.9
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.