CID 6080596

27242-80-4

Structural Information

Molecular Formula
C20H14O4
SMILES
C1=COC(=C1)C(=O)/C=C/C2=CC=C(C=C2)/C=C/C(=O)C3=CC=CO3
InChI
InChI=1S/C20H14O4/c21-17(19-3-1-13-23-19)11-9-15-5-7-16(8-6-15)10-12-18(22)20-4-2-14-24-20/h1-14H/b11-9+,12-10+
InChIKey
NZUQBRSPJPOUOM-WGDLNXRISA-N
Compound name
(E)-1-(furan-2-yl)-3-[4-[(E)-3-(furan-2-yl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.0892 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.09648 173.1
[M+Na]+ 341.07842 186.3
[M+NH4]+ 336.12302 179.5
[M+K]+ 357.05236 183.5
[M-H]- 317.08192 179.5
[M+Na-2H]- 339.06387 180.3
[M]+ 318.08865 176.7
[M]- 318.08975 176.7
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.