CID 5744450

154185-52-1

Structural Information

Molecular Formula
C26H20O5
SMILES
COC1=CC=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)OC(=CC3=O)C4=CC=C(C=C4)OC
InChI
InChI=1S/C26H20O5/c1-29-20-9-3-17(4-10-20)5-13-23(27)19-8-14-25-22(15-19)24(28)16-26(31-25)18-6-11-21(30-2)12-7-18/h3-16H,1-2H3/b13-5+
InChIKey
KTYKSWONSPXZEL-WLRTZDKTSA-N
Compound name
2-(4-methoxyphenyl)-6-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.13107 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.138346 200.0
[M+Na]+ 435.120288 208.4
[M-H]- 411.123794 211.5
[M+NH4]+ 430.164893 209.5
[M+K]+ 451.094228 204.3
[M+H-H2O]+ 395.128330 188.9
[M+HCOO]- 457.129271 220.3
[M+CH3COO]- 471.144921 226.3
[M+Na-2H]- 433.105736 202.7
[M]+ 412.13052142 205.5
[M]- 412.13161858 205.5
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.