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]+ 379.13222 186.4
[M+Na]+ 401.11416 191.8
[M-H]- 377.11766 194.4
[M+NH4]+ 396.15876 194.9
[M+K]+ 417.08810 188.9
[M+H-H2O]+ 361.12220 176.8
[M+HCOO]- 423.12314 199.6
[M+CH3COO]- 437.13879 215.1
[M+Na-2H]- 399.09961 189.1
[M]+ 378.12439 187.9
[M]- 378.12549 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.