CID 23452

7032-38-4

Structural Information

Molecular Formula
C18H23N3
SMILES
CN1CCN(CC1)C2=C3CCCCC3=NC4=CC=CC=C42
InChI
InChI=1S/C18H23N3/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/h2,4,6,8H,3,5,7,9-13H2,1H3
InChIKey
BHDKLGMXJCGESI-UHFFFAOYSA-N
Compound name
9-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydroacridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1892 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.19648 170.0
[M+Na]+ 304.17842 175.1
[M-H]- 280.18192 172.4
[M+NH4]+ 299.22302 183.1
[M+K]+ 320.15236 168.8
[M+H-H2O]+ 264.18646 158.3
[M+HCOO]- 326.18740 180.9
[M+CH3COO]- 340.20305 178.3
[M+Na-2H]- 302.16387 174.2
[M]+ 281.18865 162.9
[M]- 281.18975 162.9
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

patents stripe