CID 16077296

Bdbm199185

Structural Information

Molecular Formula
C21H22N2O
SMILES
COC1=CC=C(C=C1)CNC2=C3CCCCC3=NC4=CC=CC=C42
InChI
InChI=1S/C21H22N2O/c1-24-16-12-10-15(11-13-16)14-22-21-17-6-2-4-8-19(17)23-20-9-5-3-7-18(20)21/h2,4,6,8,10-13H,3,5,7,9,14H2,1H3,(H,22,23)
InChIKey
UEJXGDKPCPJCAE-UHFFFAOYSA-N
Compound name
N-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroacridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

318.17322 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.18050 174.9
[M+Na]+ 341.16244 180.7
[M-H]- 317.16594 180.8
[M+NH4]+ 336.20704 189.1
[M+K]+ 357.13638 174.5
[M+H-H2O]+ 301.17048 164.5
[M+HCOO]- 363.17142 193.1
[M+CH3COO]- 377.18707 184.6
[M+Na-2H]- 339.14789 181.6
[M]+ 318.17267 173.0
[M]- 318.17377 173.0
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.