CID 5045339

N,n-diethyl-4-(2-pyridyl)aniline

Structural Information

Molecular Formula

C₁₅H₁₈N₂

SMILES

CCN(CC)C1=CC=C(C=C1)C2=CC=CC=N2

InChI

InChI=1S/C15H18N2/c1-3-17(4-2)14-10-8-13(9-11-14)15-7-5-6-12-16-15/h5-12H,3-4H2,1-2H3

InChIKey

SAQPQTKYCWAAMJ-UHFFFAOYSA-N

Compound name

N,N-diethyl-4-pyridin-2-ylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 570
Patents: 226.147 Da
Monoisotopic Mass: 3.5
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]+	227.15428	153.3
[M+Na]+	249.13622	168.2
[M+NH4]+	244.18082	162.8
[M+K]+	265.11016	159.5
[M-H]-	225.13972	159.2
[M+Na-2H]-	247.12167	164.2
[M]+	226.14645	157.3
[M]-	226.14755	157.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe