CID 266865

2,5-dibenzoylcyclopentanone

Structural Information

Molecular Formula
C19H16O3
SMILES
C1CC(C(=O)C1C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H16O3/c20-17(13-7-3-1-4-8-13)15-11-12-16(19(15)22)18(21)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKey
GKAMWXSVEFELHK-UHFFFAOYSA-N
Compound name
2,5-dibenzoylcyclopentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.10995 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.117226 167.6
[M+Na]+ 315.099168 173.0
[M-H]- 291.102674 177.0
[M+NH4]+ 310.143773 183.7
[M+K]+ 331.073108 168.9
[M+H-H2O]+ 275.107210 159.6
[M+HCOO]- 337.108151 188.7
[M+CH3COO]- 351.123801 201.2
[M+Na-2H]- 313.084616 166.9
[M]+ 292.10940142 165.3
[M]- 292.11049858 165.3
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

No patent data available for this compound.