CID 10419215

3-(hydroxymethyl)piperidin-4-ol

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

C1CNCC(C1O)CO

InChI

InChI=1S/C6H13NO2/c8-4-5-3-7-2-1-6(5)9/h5-9H,1-4H2

InChIKey

FQOGWNRPPJMSEC-UHFFFAOYSA-N

Compound name

3-(hydroxymethyl)piperidin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 91
Patents: 131.09464 Da
Monoisotopic Mass: -0.6
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]+	132.10192	127.7
[M+Na]+	154.08386	137.0
[M+NH4]+	149.12846	135.1
[M+K]+	170.05780	132.5
[M-H]-	130.08736	127.2
[M+Na-2H]-	152.06931	131.0
[M]+	131.09409	128.4
[M]-	131.09519	128.4

Literature stripe

literature stripe

Patent stripe

patents stripe