CID 6434432

Benzofuran, 4,7-dimethoxy-6-(2-dimethylaminoethoxy)-5-(3,4,5-trimethoxycinnamoyl)-, maleate

Structural Information

Molecular Formula
C26H31NO8
SMILES
CN(C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC(=C(C(=C3)OC)OC)OC)OC)OC
InChI
InChI=1S/C26H31NO8/c1-27(2)11-13-35-25-21(22(31-5)17-10-12-34-23(17)26(25)33-7)18(28)9-8-16-14-19(29-3)24(32-6)20(15-16)30-4/h8-10,12,14-15H,11,13H2,1-7H3/b9-8+
InChIKey
WPAMGZQMRLPFGM-CMDGGOBGSA-N
Compound name
(E)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

485.20496 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 486.21224 217.2
[M+Na]+ 508.19418 224.8
[M-H]- 484.19768 227.6
[M+NH4]+ 503.23878 226.9
[M+K]+ 524.16812 225.4
[M+H-H2O]+ 468.20222 207.9
[M+HCOO]- 530.20316 240.3
[M+CH3COO]- 544.21881 247.3
[M+Na-2H]- 506.17963 215.6
[M]+ 485.20441 234.3
[M]- 485.20551 234.3
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.