CID 11521139

3-(piperidin-1-yl)pyridine

Structural Information

Molecular Formula

C₁₀H₁₄N₂

SMILES

C1CCN(CC1)C2=CN=CC=C2

InChI

InChI=1S/C10H14N2/c1-2-7-12(8-3-1)10-5-4-6-11-9-10/h4-6,9H,1-3,7-8H2

InChIKey

RWNRPQYVWJSAPE-UHFFFAOYSA-N

Compound name

3-piperidin-1-ylpyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 436
Patents: 162.11569 Da
Monoisotopic Mass: 1.8
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]+	163.122966	135.4
[M+Na]+	185.104908	140.6
[M-H]-	161.108414	138.2
[M+NH4]+	180.149513	152.7
[M+K]+	201.078848	138.1
[M+H-H2O]+	145.112950	126.8
[M+HCOO]-	207.113891	154.1
[M+CH3COO]-	221.129541	147.2
[M+Na-2H]-	183.090356	142.7
[M]+	162.11514142	129.7
[M]-	162.11623858	129.7

Literature stripe

literature stripe

Patent stripe

patents stripe