CID 1051478

2-(2,4-dichlorophenoxy)-n-[2-(4-methoxybenzoyl)-1-benzofuran-3-yl]acetamide

Structural Information

Molecular Formula
C24H17Cl2NO5
SMILES
COC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)COC4=C(C=C(C=C4)Cl)Cl
InChI
InChI=1S/C24H17Cl2NO5/c1-30-16-9-6-14(7-10-16)23(29)24-22(17-4-2-3-5-19(17)32-24)27-21(28)13-31-20-11-8-15(25)12-18(20)26/h2-12H,13H2,1H3,(H,27,28)
InChIKey
QVKHXKOFWAAGHI-UHFFFAOYSA-N
Compound name
2-(2,4-dichlorophenoxy)-N-[2-(4-methoxybenzoyl)-1-benzofuran-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

469.04837 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 470.055646 209.1
[M+Na]+ 492.037588 218.9
[M-H]- 468.041094 220.7
[M+NH4]+ 487.082193 219.6
[M+K]+ 508.011528 213.9
[M+H-H2O]+ 452.045630 201.1
[M+HCOO]- 514.046571 222.8
[M+CH3COO]- 528.062221 233.4
[M+Na-2H]- 490.023036 209.5
[M]+ 469.04782142 220.3
[M]- 469.04891858 220.3
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

No patent data available for this compound.