CID 21702798

1-(pyridin-2-yl)pyrrolidin-3-ol

Structural Information

Molecular Formula

C₉H₁₂N₂O

SMILES

C1CN(CC1O)C2=CC=CC=N2

InChI

InChI=1S/C9H12N2O/c12-8-4-6-11(7-8)9-3-1-2-5-10-9/h1-3,5,8,12H,4,6-7H2

InChIKey

JAVUBKWZTRFGDS-UHFFFAOYSA-N

Compound name

1-pyridin-2-ylpyrrolidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 164.09496 Da
Monoisotopic Mass: 0.8
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]+	165.10224	135.4
[M+Na]+	187.08418	147.4
[M+NH4]+	182.12878	143.9
[M+K]+	203.05812	143.0
[M-H]-	163.08768	137.6
[M+Na-2H]-	185.06963	142.5
[M]+	164.09441	137.5
[M]-	164.09551	137.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe