CID 45051410

2-(4-methoxyphenyl)-4-(4-methyl-1-piperidinyl)quinoline

Structural Information

Molecular Formula

C₂₂H₂₄N₂O

SMILES

CC1CCN(CC1)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H24N2O/c1-16-11-13-24(14-12-16)22-15-21(17-7-9-18(25-2)10-8-17)23-20-6-4-3-5-19(20)22/h3-10,15-16H,11-14H2,1-2H3

InChIKey

VLJZXYQXLYOCAQ-UHFFFAOYSA-N

Compound name

2-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)quinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 332.18887 Da
Monoisotopic Mass: 5.2
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]+	333.196146	183.3
[M+Na]+	355.178088	189.4
[M-H]-	331.181594	190.0
[M+NH4]+	350.222693	194.6
[M+K]+	371.152028	182.9
[M+H-H2O]+	315.186130	171.4
[M+HCOO]-	377.187071	198.8
[M+CH3COO]-	391.202721	192.3
[M+Na-2H]-	353.163536	186.2
[M]+	332.18832142	180.3
[M]-	332.18941858	180.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.