CID 14212772

1-(3-chlorophenyl)piperidin-4-ol

Structural Information

Molecular Formula

C₁₁H₁₄ClNO

SMILES

C1CN(CCC1O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C11H14ClNO/c12-9-2-1-3-10(8-9)13-6-4-11(14)5-7-13/h1-3,8,11,14H,4-7H2

InChIKey

GUJKBOMAIZCAQO-UHFFFAOYSA-N

Compound name

1-(3-chlorophenyl)piperidin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 211.07639 Da
Monoisotopic Mass: 2.5
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]+	212.08367	144.7
[M+Na]+	234.06561	158.9
[M+NH4]+	229.11021	154.2
[M+K]+	250.03955	151.0
[M-H]-	210.06911	148.6
[M+Na-2H]-	232.05106	152.7
[M]+	211.07584	148.1
[M]-	211.07694	148.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe