CID 11458178

1-(4-aminophenyl)piperidin-2-one

Structural Information

Molecular Formula

C₁₁H₁₄N₂O

SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)N

InChI

InChI=1S/C11H14N2O/c12-9-4-6-10(7-5-9)13-8-2-1-3-11(13)14/h4-7H,1-3,8,12H2

InChIKey

XWDUBOSLSYWJTR-UHFFFAOYSA-N

Compound name

1-(4-aminophenyl)piperidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 221
Patents: 190.11061 Da
Monoisotopic Mass: 1.0
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]+	191.11789	142.3
[M+Na]+	213.09983	154.7
[M+NH4]+	208.14443	151.0
[M+K]+	229.07377	147.9
[M-H]-	189.10333	146.5
[M+Na-2H]-	211.08528	149.9
[M]+	190.11006	145.1
[M]-	190.11116	145.1

Literature stripe

literature stripe

Patent stripe

patents stripe