CID 218367

7-methoxy-9-(4-(2-methylphenyl)-1-piperazinyl)-2,3-dihydro-1h-cyclopenta(b)quinoline

Structural Information

Molecular Formula
C24H27N3O
SMILES
CC1=CC=CC=C1N2CCN(CC2)C3=C4CCCC4=NC5=C3C=C(C=C5)OC
InChI
InChI=1S/C24H27N3O/c1-17-6-3-4-9-23(17)26-12-14-27(15-13-26)24-19-7-5-8-21(19)25-22-11-10-18(28-2)16-20(22)24/h3-4,6,9-11,16H,5,7-8,12-15H2,1-2H3
InChIKey
VVWAQVRTZWSURP-UHFFFAOYSA-N
Compound name
7-methoxy-9-[4-(2-methylphenyl)piperazin-1-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

373.21542 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.222696 194.8
[M+Na]+ 396.204638 201.0
[M-H]- 372.208144 201.2
[M+NH4]+ 391.249243 205.9
[M+K]+ 412.178578 193.5
[M+H-H2O]+ 356.212680 182.3
[M+HCOO]- 418.213621 207.3
[M+CH3COO]- 432.229271 202.7
[M+Na-2H]- 394.190086 194.3
[M]+ 373.21487142 191.5
[M]- 373.21596858 191.5
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.