CID 6434293

41226-04-4

Structural Information

Molecular Formula
C24H27NO7
SMILES
CN(C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=C(C(=CC=C3)OC)O)OC)OC
InChI
InChI=1S/C24H27NO7/c1-25(2)12-14-32-23-19(21(29-4)16-11-13-31-22(16)24(23)30-5)17(26)10-9-15-7-6-8-18(28-3)20(15)27/h6-11,13,27H,12,14H2,1-5H3/b10-9+
InChIKey
ZDLUNPJQHMAANM-MDZDMXLPSA-N
Compound name
(E)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(2-hydroxy-3-methoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

441.17874 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 442.18602 205.6
[M+Na]+ 464.16796 217.5
[M+NH4]+ 459.21256 210.0
[M+K]+ 480.14190 214.1
[M-H]- 440.17146 209.3
[M+Na-2H]- 462.15341 208.8
[M]+ 441.17819 208.2
[M]- 441.17929 208.2
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.