CID 166280

1-(4-phenyl-2-quinolyl)piperazine

Structural Information

Molecular Formula

C₁₉H₁₉N₃

SMILES

C1CN(CCN1)C2=NC3=CC=CC=C3C(=C2)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3/c1-2-6-15(7-3-1)17-14-19(22-12-10-20-11-13-22)21-18-9-5-4-8-16(17)18/h1-9,14,20H,10-13H2

InChIKey

LYLBRVQNLFMNLN-UHFFFAOYSA-N

Compound name

4-phenyl-2-piperazin-1-ylquinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 9
Patents: 289.1579 Da
Monoisotopic Mass: 3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	290.16518	171.4
[M+Na]+	312.14712	188.1
[M+NH4]+	307.19172	180.7
[M+K]+	328.12106	178.1
[M-H]-	288.15062	177.9
[M+Na-2H]-	310.13257	182.1
[M]+	289.15735	175.8
[M]-	289.15845	175.8

Literature stripe

literature stripe

Patent stripe

patents stripe