CID 77434192

Ns00117008

Structural Information

Molecular Formula
C18H24N2O5S
SMILES
CC(CC1=CC(=C(C=C1)OC)S(=O)(=O)N)NCCOC2=CC=CC=C2O
InChI
InChI=1S/C18H24N2O5S/c1-13(20-9-10-25-16-6-4-3-5-15(16)21)11-14-7-8-17(24-2)18(12-14)26(19,22)23/h3-8,12-13,20-21H,9-11H2,1-2H3,(H2,19,22,23)
InChIKey
CIJUMNQLYUKWIH-UHFFFAOYSA-N
Compound name
5-[2-[2-(2-hydroxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.1406 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.147876 187.2
[M+Na]+ 403.129818 192.0
[M-H]- 379.133324 191.6
[M+NH4]+ 398.174423 197.6
[M+K]+ 419.103758 187.9
[M+H-H2O]+ 363.137860 178.6
[M+HCOO]- 425.138801 203.4
[M+CH3COO]- 439.154451 218.8
[M+Na-2H]- 401.115266 188.4
[M]+ 380.14005142 191.1
[M]- 380.14114858 191.1
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.