CID 1739315

3-methylphenyl 2-(4-methylphenyl)-4-quinolinecarboxylate

Structural Information

Molecular Formula
C24H19NO2
SMILES
CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=CC(=C4)C
InChI
InChI=1S/C24H19NO2/c1-16-10-12-18(13-11-16)23-15-21(20-8-3-4-9-22(20)25-23)24(26)27-19-7-5-6-17(2)14-19/h3-15H,1-2H3
InChIKey
HRUISVHDUHWGNM-UHFFFAOYSA-N
Compound name
(3-methylphenyl) 2-(4-methylphenyl)quinoline-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]+ 354.14885 186.3
[M+Na]+ 376.13079 205.2
[M+NH4]+ 371.17539 195.4
[M+K]+ 392.10473 194.7
[M-H]- 352.13429 194.2
[M+Na-2H]- 374.11624 198.2
[M]+ 353.14102 191.7
[M]- 353.14212 191.7
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.