CID 3007385

108664-24-0

Structural Information

Molecular Formula
C20H15NO2
SMILES
C=C(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)N3C=CC=CC3=O
InChI
InChI=1S/C20H15NO2/c1-15(21-14-6-5-9-19(21)22)20(23)18-12-10-17(11-13-18)16-7-3-2-4-8-16/h2-14H,1H2
InChIKey
KBLNPQMMYCILNR-UHFFFAOYSA-N
Compound name
1-[3-oxo-3-(4-phenylphenyl)prop-1-en-2-yl]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

301.1103 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.11758 169.6
[M+Na]+ 324.09952 176.7
[M-H]- 300.10302 177.8
[M+NH4]+ 319.14412 182.2
[M+K]+ 340.07346 170.9
[M+H-H2O]+ 284.10756 159.6
[M+HCOO]- 346.10850 190.7
[M+CH3COO]- 360.12415 204.4
[M+Na-2H]- 322.08497 173.1
[M]+ 301.10975 168.6
[M]- 301.11085 168.6
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.