CID 3784899

2-methylphenyl 8-methyl-2-phenyl-4-quinolinecarboxylate

Structural Information

Molecular Formula
C24H19NO2
SMILES
CC1=C2C(=CC=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=CC=CC=C4C
InChI
InChI=1S/C24H19NO2/c1-16-9-6-7-14-22(16)27-24(26)20-15-21(18-11-4-3-5-12-18)25-23-17(2)10-8-13-19(20)23/h3-15H,1-2H3
InChIKey
FALYZZVIQLKIFJ-UHFFFAOYSA-N
Compound name
(2-methylphenyl) 8-methyl-2-phenylquinoline-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.14157 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.148846 187.0
[M+Na]+ 376.130788 195.2
[M-H]- 352.134294 196.3
[M+NH4]+ 371.175393 198.9
[M+K]+ 392.104728 188.8
[M+H-H2O]+ 336.138830 175.9
[M+HCOO]- 398.139771 206.8
[M+CH3COO]- 412.155421 197.3
[M+Na-2H]- 374.116236 190.8
[M]+ 353.14102142 188.5
[M]- 353.14211858 188.5
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.