CID 6434289

Benzofuran, 4,7-dimethoxy-6-(2-dimethylaminoethoxy)-5-(o-methoxycinnamoyl)-, maleate

Structural Information

Molecular Formula
C24H27NO6
SMILES
CN(C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=CC=C3OC)OC)OC
InChI
InChI=1S/C24H27NO6/c1-25(2)13-15-31-23-20(18(26)11-10-16-8-6-7-9-19(16)27-3)21(28-4)17-12-14-30-22(17)24(23)29-5/h6-12,14H,13,15H2,1-5H3/b11-10+
InChIKey
NGVCOVJMCXJAMS-ZHACJKMWSA-N
Compound name
(E)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(2-methoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

425.18384 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.19112 203.8
[M+Na]+ 448.17306 211.3
[M-H]- 424.17656 213.9
[M+NH4]+ 443.21766 215.8
[M+K]+ 464.14700 210.4
[M+H-H2O]+ 408.18110 194.9
[M+HCOO]- 470.18204 227.5
[M+CH3COO]- 484.19769 234.5
[M+Na-2H]- 446.15851 204.0
[M]+ 425.18329 216.6
[M]- 425.18439 216.6
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.