CID 23453

7032-39-5

Structural Information

Molecular Formula
C23H25N3
SMILES
C1CCC2=NC3=CC=CC=C3C(=C2C1)N4CCN(CC4)C5=CC=CC=C5
InChI
InChI=1S/C23H25N3/c1-2-8-18(9-3-1)25-14-16-26(17-15-25)23-19-10-4-6-12-21(19)24-22-13-7-5-11-20(22)23/h1-4,6,8-10,12H,5,7,11,13-17H2
InChIKey
ZGGFKRVGXHWHPM-UHFFFAOYSA-N
Compound name
9-(4-phenylpiperazin-1-yl)-1,2,3,4-tetrahydroacridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.20483 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.21211 185.7
[M+Na]+ 366.19405 189.6
[M-H]- 342.19755 190.5
[M+NH4]+ 361.23865 195.2
[M+K]+ 382.16799 181.5
[M+H-H2O]+ 326.20209 171.8
[M+HCOO]- 388.20303 195.9
[M+CH3COO]- 402.21868 192.5
[M+Na-2H]- 364.17950 189.4
[M]+ 343.20428 177.3
[M]- 343.20538 177.3
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.