CID 412

3-(pyrrolidin-2-yl)pyridine

Structural Information

Molecular Formula

C₉H₁₂N₂

SMILES

C1CC(NC1)C2=CN=CC=C2

InChI

InChI=1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2

InChIKey

MYKUKUCHPMASKF-UHFFFAOYSA-N

Compound name

3-pyrrolidin-2-ylpyridine

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 244
References: 7691
Patents: 148.10005 Da
Monoisotopic Mass: 0.2
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]+	149.10733	132.5
[M+Na]+	171.08927	144.6
[M+NH4]+	166.13387	141.6
[M+K]+	187.06321	139.5
[M-H]-	147.09277	135.2
[M+Na-2H]-	169.07472	140.3
[M]+	148.09950	134.8
[M]-	148.10060	134.8

Literature stripe

literature stripe

Patent stripe

patents stripe