CID 3058558

75410-83-2

Structural Information

Molecular Formula
C24H26N4
SMILES
C1CN(CCN1CCCC2=CNC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4
InChI
InChI=1S/C24H26N4/c1-3-9-22-19(6-1)11-12-24(26-22)28-16-14-27(15-17-28)13-5-7-20-18-25-23-10-4-2-8-21(20)23/h1-4,6,8-12,18,25H,5,7,13-17H2
InChIKey
STFQKJFRVITFLN-UHFFFAOYSA-N
Compound name
2-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.21576 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.223036 191.7
[M+Na]+ 393.204978 197.9
[M-H]- 369.208484 195.4
[M+NH4]+ 388.249583 200.5
[M+K]+ 409.178918 188.2
[M+H-H2O]+ 353.213020 178.6
[M+HCOO]- 415.213961 204.0
[M+CH3COO]- 429.229611 198.8
[M+Na-2H]- 391.190426 194.4
[M]+ 370.21521142 187.8
[M]- 370.21630858 187.8
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.