CID 84226

N,n-dibenzylpyridine-4-methylamine

Structural Information

Molecular Formula

C₂₀H₂₀N₂

SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)CC3=CC=NC=C3

InChI

InChI=1S/C20H20N2/c1-3-7-18(8-4-1)15-22(16-19-9-5-2-6-10-19)17-20-11-13-21-14-12-20/h1-14H,15-17H2

InChIKey

BPLXDKVKYBVOAB-UHFFFAOYSA-N

Compound name

N-benzyl-1-phenyl-N-(pyridin-4-ylmethyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 288.16266 Da
Monoisotopic Mass: 3.7
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]+	289.169936	169.0
[M+Na]+	311.151878	173.5
[M-H]-	287.155384	177.4
[M+NH4]+	306.196483	182.3
[M+K]+	327.125818	168.3
[M+H-H2O]+	271.159920	158.1
[M+HCOO]-	333.160861	192.6
[M+CH3COO]-	347.176511	179.6
[M+Na-2H]-	309.137326	176.1
[M]+	288.16211142	168.2
[M]-	288.16320858	168.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.