CID 6434311

Benzofuran, 4,7-dimethoxy-6-(2-dimethylaminoethoxy)-5-(p-ethoxycinnamoyl)-, oxalate

Structural Information

Molecular Formula
C25H29NO6
SMILES
CCOC1=CC=C(C=C1)/C=C/C(=O)C2=C(C3=C(C(=C2OCCN(C)C)OC)OC=C3)OC
InChI
InChI=1S/C25H29NO6/c1-6-30-18-10-7-17(8-11-18)9-12-20(27)21-22(28-4)19-13-15-31-23(19)25(29-5)24(21)32-16-14-26(2)3/h7-13,15H,6,14,16H2,1-5H3/b12-9+
InChIKey
FCAPAWNPEMNYJT-FMIVXFBMSA-N
Compound name
(E)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(4-ethoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

439.1995 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 440.20678 206.6
[M+Na]+ 462.18872 219.0
[M+NH4]+ 457.23332 211.8
[M+K]+ 478.16266 214.3
[M-H]- 438.19222 211.3
[M+Na-2H]- 460.17417 210.8
[M]+ 439.19895 209.6
[M]- 439.20005 209.6
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.