CID 3050292

66147-44-2

Structural Information

Molecular Formula
C23H20N2O2
SMILES
CC1=CC=CC2=C(C3=CC=CC=C3N=C12)NC4=CC=C(C=C4)CCC(=O)O
InChI
InChI=1S/C23H20N2O2/c1-15-5-4-7-19-22(15)25-20-8-3-2-6-18(20)23(19)24-17-12-9-16(10-13-17)11-14-21(26)27/h2-10,12-13H,11,14H2,1H3,(H,24,25)(H,26,27)
InChIKey
WPNLEVAAVSLIMJ-UHFFFAOYSA-N
Compound name
3-[4-[(4-methylacridin-9-yl)amino]phenyl]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

356.15247 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.15975 186.6
[M+Na]+ 379.14169 203.7
[M+NH4]+ 374.18629 195.1
[M+K]+ 395.11563 193.8
[M-H]- 355.14519 192.8
[M+Na-2H]- 377.12714 195.9
[M]+ 356.15192 191.0
[M]- 356.15302 191.0
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.