CID 458795

2-piperidinoaniline

Structural Information

Molecular Formula

C₁₁H₁₆N₂

SMILES

C1CCN(CC1)C2=CC=CC=C2N

InChI

InChI=1S/C11H16N2/c12-10-6-2-3-7-11(10)13-8-4-1-5-9-13/h2-3,6-7H,1,4-5,8-9,12H2

InChIKey

OYECAJPUPWFCSL-UHFFFAOYSA-N

Compound name

2-piperidin-1-ylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 429
Patents: 176.13135 Da
Monoisotopic Mass: 2.2
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]+	177.13863	140.2
[M+Na]+	199.12057	152.6
[M+NH4]+	194.16517	149.7
[M+K]+	215.09451	145.2
[M-H]-	175.12407	145.1
[M+Na-2H]-	197.10602	148.6
[M]+	176.13080	143.3
[M]-	176.13190	143.3

Literature stripe

literature stripe

Patent stripe

patents stripe