CID 88244

19780-85-9

Structural Information

Molecular Formula

C₁₀H₂₁NO₂

SMILES

C1CN(CCC1CCCO)CCO

InChI

InChI=1S/C10H21NO2/c12-8-1-2-10-3-5-11(6-4-10)7-9-13/h10,12-13H,1-9H2

InChIKey

QCZXNEGHMZUDNS-UHFFFAOYSA-N

Compound name

3-[1-(2-hydroxyethyl)piperidin-4-yl]propan-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 67
Patents: 187.15723 Da
Monoisotopic Mass: 0.4
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]+	188.16451	145.9
[M+Na]+	210.14645	149.8
[M-H]-	186.14995	144.1
[M+NH4]+	205.19105	162.9
[M+K]+	226.12039	147.5
[M+H-H2O]+	170.15449	139.5
[M+HCOO]-	232.15543	161.9
[M+CH3COO]-	246.17108	178.0
[M+Na-2H]-	208.13190	148.8
[M]+	187.15668	141.9
[M]-	187.15778	141.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe