CID 3126360

N-(4-methoxyphenyl)-1,2,3,4-tetrahydro-9-acridinecarboxamide

Structural Information

Molecular Formula
C21H20N2O2
SMILES
COC1=CC=C(C=C1)NC(=O)C2=C3CCCCC3=NC4=CC=CC=C42
InChI
InChI=1S/C21H20N2O2/c1-25-15-12-10-14(11-13-15)22-21(24)20-16-6-2-4-8-18(16)23-19-9-5-3-7-17(19)20/h2,4,6,8,10-13H,3,5,7,9H2,1H3,(H,22,24)
InChIKey
VERQLHCZINOUTB-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

332.15247 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.15975 177.5
[M+Na]+ 355.14169 183.2
[M-H]- 331.14519 183.6
[M+NH4]+ 350.18629 190.9
[M+K]+ 371.11563 177.6
[M+H-H2O]+ 315.14973 167.2
[M+HCOO]- 377.15067 195.1
[M+CH3COO]- 391.16632 187.0
[M+Na-2H]- 353.12714 183.2
[M]+ 332.15192 175.6
[M]- 332.15302 175.6
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.