CID 520495

4,6-dibenzoylresorcinol

Structural Information

Molecular Formula
C20H14O4
SMILES
C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2O)O)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C20H14O4/c21-17-12-18(22)16(20(24)14-9-5-2-6-10-14)11-15(17)19(23)13-7-3-1-4-8-13/h1-12,21-22H
InChIKey
GOZHNJTXLALKRL-UHFFFAOYSA-N
Compound name
(5-benzoyl-2,4-dihydroxyphenyl)-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8663
Patents

318.0892 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.09648 173.8
[M+Na]+ 341.07842 189.0
[M+NH4]+ 336.12302 180.9
[M+K]+ 357.05236 182.1
[M-H]- 317.08192 178.9
[M+Na-2H]- 339.06387 183.5
[M]+ 318.08865 177.4
[M]- 318.08975 177.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe