CID 60597

9-(4-methyl-1-piperazinyl)acridine

Structural Information

Molecular Formula
C18H19N3
SMILES
CN1CCN(CC1)C2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C18H19N3/c1-20-10-12-21(13-11-20)18-14-6-2-4-8-16(14)19-17-9-5-3-7-15(17)18/h2-9H,10-13H2,1H3
InChIKey
XHTLDEKMWBOVSQ-UHFFFAOYSA-N
Compound name
9-(4-methylpiperazin-1-yl)acridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1579 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.16518 166.8
[M+Na]+ 300.14712 184.5
[M+NH4]+ 295.19172 176.7
[M+K]+ 316.12106 174.3
[M-H]- 276.15062 172.4
[M+Na-2H]- 298.13257 176.2
[M]+ 277.15735 171.2
[M]- 277.15845 171.2
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.