CID 28830243

Methyl 3-(4-hydroxypiperidin-1-yl)propanoate

Structural Information

Molecular Formula

C₉H₁₇NO₃

SMILES

COC(=O)CCN1CCC(CC1)O

InChI

InChI=1S/C9H17NO3/c1-13-9(12)4-7-10-5-2-8(11)3-6-10/h8,11H,2-7H2,1H3

InChIKey

BMOZRIPGPNWTIO-UHFFFAOYSA-N

Compound name

methyl 3-(4-hydroxypiperidin-1-yl)propanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 187.12085 Da
Monoisotopic Mass: 0.0
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]+	188.12813	142.6
[M+Na]+	210.11007	151.7
[M+NH4]+	205.15467	149.4
[M+K]+	226.08401	147.2
[M-H]-	186.11357	142.1
[M+Na-2H]-	208.09552	145.5
[M]+	187.12030	143.4
[M]-	187.12140	143.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe