CID 281515

3-(2-hydroxyethyl)piperidin-2-one

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C1CC(C(=O)NC1)CCO

InChI

InChI=1S/C7H13NO2/c9-5-3-6-2-1-4-8-7(6)10/h6,9H,1-5H2,(H,8,10)

InChIKey

KXEFHGQHMLWLJC-UHFFFAOYSA-N

Compound name

3-(2-hydroxyethyl)piperidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 143.09464 Da
Monoisotopic Mass: -0.3
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]+	144.10192	131.1
[M+Na]+	166.08386	140.9
[M+NH4]+	161.12846	138.5
[M+K]+	182.05780	135.8
[M-H]-	142.08736	130.9
[M+Na-2H]-	164.06931	134.7
[M]+	143.09409	132.0
[M]-	143.09519	132.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe