CID 79567102

3-(methoxymethyl)piperidin-3-ol

Structural Information

Molecular Formula

C₇H₁₅NO₂

SMILES

COCC1(CCCNC1)O

InChI

InChI=1S/C7H15NO2/c1-10-6-7(9)3-2-4-8-5-7/h8-9H,2-6H2,1H3

InChIKey

ZRSHNSRETGKOHT-UHFFFAOYSA-N

Compound name

3-(methoxymethyl)piperidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 145.11028 Da
Monoisotopic Mass: -0.7
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]+	146.11756	132.5
[M+Na]+	168.09950	142.0
[M+NH4]+	163.14410	141.6
[M+K]+	184.07344	135.1
[M-H]-	144.10300	132.5
[M+Na-2H]-	166.08495	138.0
[M]+	145.10973	133.7
[M]-	145.11083	133.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe