CID 6480226

(z)-3-(3-benzoylphenyl)-3-hydroxy-1-(2-hydroxyphenyl)prop-2-en-1-one

Structural Information

Molecular Formula
C22H16O4
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=CC(=C2)/C(=C/C(=O)C3=CC=CC=C3O)/O
InChI
InChI=1S/C22H16O4/c23-19-12-5-4-11-18(19)21(25)14-20(24)16-9-6-10-17(13-16)22(26)15-7-2-1-3-8-15/h1-14,23-24H/b20-14-
InChIKey
MUUUAVDQEYFBGM-ZHZULCJRSA-N
Compound name
(Z)-3-(3-benzoylphenyl)-3-hydroxy-1-(2-hydroxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.10486 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.11214 180.5
[M+Na]+ 367.09408 185.3
[M-H]- 343.09758 187.3
[M+NH4]+ 362.13868 191.1
[M+K]+ 383.06802 179.9
[M+H-H2O]+ 327.10212 171.6
[M+HCOO]- 389.10306 198.7
[M+CH3COO]- 403.11871 207.5
[M+Na-2H]- 365.07953 180.9
[M]+ 344.10431 178.3
[M]- 344.10541 178.3
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.