CID 280434

3,4,5-triphenyl-2(3h)-furanone

Structural Information

Molecular Formula
C22H16O2
SMILES
C1=CC=C(C=C1)C2C(=C(OC2=O)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H16O2/c23-22-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(24-22)18-14-8-3-9-15-18/h1-15,20H
InChIKey
VOVDJMDRGHNHQX-UHFFFAOYSA-N
Compound name
3,4,5-triphenyl-3H-furan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.11502 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.12230 173.2
[M+Na]+ 335.10424 181.1
[M-H]- 311.10774 186.9
[M+NH4]+ 330.14884 187.5
[M+K]+ 351.07818 176.2
[M+H-H2O]+ 295.11228 164.3
[M+HCOO]- 357.11322 196.5
[M+CH3COO]- 371.12887 185.5
[M+Na-2H]- 333.08969 176.2
[M]+ 312.11447 172.9
[M]- 312.11557 172.9
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.