CID 46667

64046-82-8

Structural Information

Molecular Formula
C21H26ClN3O
SMILES
CC(CCCN(C)C)NC1=C2C(=CC(=C1)OC)C=C3C=C(C=CC3=N2)Cl
InChI
InChI=1S/C21H26ClN3O/c1-14(6-5-9-25(2)3)23-20-13-18(26-4)12-16-10-15-11-17(22)7-8-19(15)24-21(16)20/h7-8,10-14,23H,5-6,9H2,1-4H3
InChIKey
VZLSHAUEBAEMHM-UHFFFAOYSA-N
Compound name
4-N-(7-chloro-2-methoxyacridin-4-yl)-1-N,1-N-dimethylpentane-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.17645 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.18373 189.9
[M+Na]+ 394.16567 205.2
[M+NH4]+ 389.21027 198.7
[M+K]+ 410.13961 195.5
[M-H]- 370.16917 195.0
[M+Na-2H]- 392.15112 196.7
[M]+ 371.17590 194.0
[M]- 371.17700 194.0
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.