CID 465662

Chembl415908

Structural Information

Molecular Formula
C28H32N2O5
SMILES
CCN(CC)CCOC1=CC=C(C=C1)NC(=O)COC2=CC=CC=C2C(=O)C3=CC=C(C=C3)OC
InChI
InChI=1S/C28H32N2O5/c1-4-30(5-2)18-19-34-24-16-12-22(13-17-24)29-27(31)20-35-26-9-7-6-8-25(26)28(32)21-10-14-23(33-3)15-11-21/h6-17H,4-5,18-20H2,1-3H3,(H,29,31)
InChIKey
SBEAODWFNJHFMO-UHFFFAOYSA-N
Compound name
N-[4-[2-(diethylamino)ethoxy]phenyl]-2-[2-(4-methoxybenzoyl)phenoxy]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

476.2311 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 477.23838 218.7
[M+Na]+ 499.22032 220.3
[M-H]- 475.22382 228.2
[M+NH4]+ 494.26492 225.1
[M+K]+ 515.19426 217.9
[M+H-H2O]+ 459.22836 206.4
[M+HCOO]- 521.22930 241.0
[M+CH3COO]- 535.24495 246.0
[M+Na-2H]- 497.20577 217.6
[M]+ 476.23055 224.8
[M]- 476.23165 224.8
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.