CID 1330410

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

Structural Information

Molecular Formula
C25H21NO6
SMILES
COC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=CC(=C(C=C4)OC)OC
InChI
InChI=1S/C25H21NO6/c1-29-17-11-8-15(9-12-17)23(27)24-22(18-6-4-5-7-19(18)32-24)26-25(28)16-10-13-20(30-2)21(14-16)31-3/h4-14H,1-3H3,(H,26,28)
InChIKey
JVZNVYLQQMLRIQ-UHFFFAOYSA-N
Compound name
3,4-dimethoxy-N-[2-(4-methoxybenzoyl)-1-benzofuran-3-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

431.1369 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.144176 202.7
[M+Na]+ 454.126118 210.4
[M-H]- 430.129624 215.1
[M+NH4]+ 449.170723 213.0
[M+K]+ 470.100058 208.5
[M+H-H2O]+ 414.134160 193.1
[M+HCOO]- 476.135101 225.7
[M+CH3COO]- 490.150751 231.5
[M+Na-2H]- 452.111566 204.1
[M]+ 431.13635142 211.3
[M]- 431.13744858 211.3
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.