CID 1051477

3-methoxy-n-[2-(4-methoxybenzoyl)-1-benzofuran-3-yl]benzamide

Structural Information

Molecular Formula
C24H19NO5
SMILES
COC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=CC(=CC=C4)OC
InChI
InChI=1S/C24H19NO5/c1-28-17-12-10-15(11-13-17)22(26)23-21(19-8-3-4-9-20(19)30-23)25-24(27)16-6-5-7-18(14-16)29-2/h3-14H,1-2H3,(H,25,27)
InChIKey
QCNUNAPYQDOTQM-UHFFFAOYSA-N
Compound name
3-methoxy-N-[2-(4-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

401.1263 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.13358 195.3
[M+Na]+ 424.11552 202.9
[M-H]- 400.11902 207.5
[M+NH4]+ 419.16012 206.7
[M+K]+ 440.08946 200.3
[M+H-H2O]+ 384.12356 185.9
[M+HCOO]- 446.12450 218.6
[M+CH3COO]- 460.14015 225.1
[M+Na-2H]- 422.10097 197.7
[M]+ 401.12575 201.8
[M]- 401.12685 201.8
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.