CID 885405

2-methylphenyl 2-phenyl-4-quinolinecarboxylate

Structural Information

Molecular Formula
C23H17NO2
SMILES
CC1=CC=CC=C1OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C23H17NO2/c1-16-9-5-8-14-22(16)26-23(25)19-15-21(17-10-3-2-4-11-17)24-20-13-7-6-12-18(19)20/h2-15H,1H3
InChIKey
LONUEIGJGYNVNX-UHFFFAOYSA-N
Compound name
(2-methylphenyl) 2-phenylquinoline-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.12592 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.13320 181.8
[M+Na]+ 362.11514 200.5
[M+NH4]+ 357.15974 191.1
[M+K]+ 378.08908 190.1
[M-H]- 338.11864 189.7
[M+Na-2H]- 360.10059 194.2
[M]+ 339.12537 187.1
[M]- 339.12647 187.1
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.