CID 5270860

1-[4-[(2-methoxyacridin-9-yl)amino]phenyl]ethanone

Structural Information

Molecular Formula
C22H18N2O2
SMILES
CC(=O)C1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC4=CC=CC=C42)OC
InChI
InChI=1S/C22H18N2O2/c1-14(25)15-7-9-16(10-8-15)23-22-18-5-3-4-6-20(18)24-21-12-11-17(26-2)13-19(21)22/h3-13H,1-2H3,(H,23,24)
InChIKey
KAMDZGNRRXGDPJ-UHFFFAOYSA-N
Compound name
1-[4-[(2-methoxyacridin-9-yl)amino]phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

342.13684 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.14412 181.3
[M+Na]+ 365.12606 190.3
[M-H]- 341.12956 188.8
[M+NH4]+ 360.17066 194.7
[M+K]+ 381.10000 184.2
[M+H-H2O]+ 325.13410 170.9
[M+HCOO]- 387.13504 202.6
[M+CH3COO]- 401.15069 192.1
[M+Na-2H]- 363.11151 188.6
[M]+ 342.13629 184.5
[M]- 342.13739 184.5
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.