CID 14028796

152165-67-8

Structural Information

Molecular Formula
C26H20O5
SMILES
CCCCOC1=CC=C(C=C1)C2=C3C=C4C(=C(C(=O)O4)C5=CC=CC=C5)C=C3OC2=O
InChI
InChI=1S/C26H20O5/c1-2-3-13-29-18-11-9-17(10-12-18)24-20-15-21-19(14-22(20)31-26(24)28)23(25(27)30-21)16-7-5-4-6-8-16/h4-12,14-15H,2-3,13H2,1H3
InChIKey
OZIVGRCTLVMJJN-UHFFFAOYSA-N
Compound name
3-(4-butoxyphenyl)-7-phenylfuro[2,3-f][1]benzofuran-2,6-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

13
Patents

412.13107 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.138346 198.4
[M+Na]+ 435.120288 208.9
[M-H]- 411.123794 212.7
[M+NH4]+ 430.164893 211.8
[M+K]+ 451.094228 205.5
[M+H-H2O]+ 395.128330 191.2
[M+HCOO]- 457.129271 220.0
[M+CH3COO]- 471.144921 210.4
[M+Na-2H]- 433.105736 199.1
[M]+ 412.13052142 207.0
[M]- 412.13161858 207.0
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

patents stripe