CID 14920287

1-benzoylpiperidin-3-ol

Structural Information

Molecular Formula

C₁₂H₁₅NO₂

SMILES

C1CC(CN(C1)C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C12H15NO2/c14-11-7-4-8-13(9-11)12(15)10-5-2-1-3-6-10/h1-3,5-6,11,14H,4,7-9H2

InChIKey

OAWOPHHIXXHCOX-UHFFFAOYSA-N

Compound name

(3-hydroxypiperidin-1-yl)-phenylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 205.11028 Da
Monoisotopic Mass: 1.3
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]+	206.11756	145.9
[M+Na]+	228.09950	150.7
[M-H]-	204.10300	149.1
[M+NH4]+	223.14410	162.3
[M+K]+	244.07344	147.9
[M+H-H2O]+	188.10754	138.3
[M+HCOO]-	250.10848	163.4
[M+CH3COO]-	264.12413	181.6
[M+Na-2H]-	226.08495	149.6
[M]+	205.10973	140.4
[M]-	205.11083	140.4

Literature stripe

literature stripe

Patent stripe

patents stripe