CID 22023

5782-95-6

Structural Information

Molecular Formula
C23H26N2O2
SMILES
COC1=C(C=C(C=C1)CCNC2=C3CCCCC3=NC4=CC=CC=C42)OC
InChI
InChI=1S/C23H26N2O2/c1-26-21-12-11-16(15-22(21)27-2)13-14-24-23-17-7-3-5-9-19(17)25-20-10-6-4-8-18(20)23/h3,5,7,9,11-12,15H,4,6,8,10,13-14H2,1-2H3,(H,24,25)
InChIKey
CWOSTJOZRVRLJV-UHFFFAOYSA-N
Compound name
N-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,3,4-tetrahydroacridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

362.19943 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.20671 187.9
[M+Na]+ 385.18865 193.5
[M-H]- 361.19215 193.8
[M+NH4]+ 380.23325 200.5
[M+K]+ 401.16259 187.7
[M+H-H2O]+ 345.19669 177.0
[M+HCOO]- 407.19763 205.5
[M+CH3COO]- 421.21328 196.9
[M+Na-2H]- 383.17410 192.9
[M]+ 362.19888 188.4
[M]- 362.19998 188.4
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.