CID 70339624

5-methoxypiperidin-2-one

Structural Information

Molecular Formula

C₆H₁₁NO₂

SMILES

COC1CCC(=O)NC1

InChI

InChI=1S/C6H11NO2/c1-9-5-2-3-6(8)7-4-5/h5H,2-4H2,1H3,(H,7,8)

InChIKey

JKGZICZSRXYNHR-UHFFFAOYSA-N

Compound name

5-methoxypiperidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 129.07898 Da
Monoisotopic Mass: -0.5
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]+	130.08626	126.3
[M+Na]+	152.06820	136.8
[M+NH4]+	147.11280	134.3
[M+K]+	168.04214	131.7
[M-H]-	128.07170	126.7
[M+Na-2H]-	150.05365	130.8
[M]+	129.07843	127.6
[M]-	129.07953	127.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe