CID 131752987

1-(4-hydroxy-3-methoxyphenyl)-5-(4-hydroxyphenyl)-1,4-pentadien-3-one

Structural Information

Molecular Formula
C18H16O4
SMILES
COC1=C(C=CC(=C1)/C=C\C(=O)/C=C\C2=CC=C(C=C2)O)O
InChI
InChI=1S/C18H16O4/c1-22-18-12-14(6-11-17(18)21)5-10-16(20)9-4-13-2-7-15(19)8-3-13/h2-12,19,21H,1H3/b9-4-,10-5-
InChIKey
QVRYUUYYIWAQHV-AVWDGMTFSA-N
Compound name
(1Z,4Z)-1-(4-hydroxy-3-methoxyphenyl)-5-(4-hydroxyphenyl)penta-1,4-dien-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.10486 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.11214 169.6
[M+Na]+ 319.09408 182.7
[M+NH4]+ 314.13868 175.7
[M+K]+ 335.06802 175.8
[M-H]- 295.09758 171.8
[M+Na-2H]- 317.07953 175.9
[M]+ 296.10431 171.9
[M]- 296.10541 171.9
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.