CID 350338

84627-12-3

Structural Information

Molecular Formula
C32H22O4
SMILES
C1=CC=C(C=C1)C2=C(C=CC(=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5)O)C6=CC=CC=C6)O
InChI
InChI=1S/C32H22O4/c33-29-17-15-23(19-26(29)21-9-3-1-4-10-21)32(28-14-8-7-13-25(28)31(35)36-32)24-16-18-30(34)27(20-24)22-11-5-2-6-12-22/h1-20,33-34H
InChIKey
TYHJGSAUZOLXEM-UHFFFAOYSA-N
Compound name
3,3-bis(4-hydroxy-3-phenylphenyl)-2-benzofuran-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

470.1518 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 471.15908 217.4
[M+Na]+ 493.14102 236.9
[M+NH4]+ 488.18562 227.3
[M+K]+ 509.11496 225.8
[M-H]- 469.14452 229.8
[M+Na-2H]- 491.12647 230.8
[M]+ 470.15125 224.3
[M]- 470.15235 224.3
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

patents stripe