CID 2794673

2-piperidinonicotinic acid

Structural Information

Molecular Formula

C₁₁H₁₄N₂O₂

SMILES

C1CCN(CC1)C2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C11H14N2O2/c14-11(15)9-5-4-6-12-10(9)13-7-2-1-3-8-13/h4-6H,1-3,7-8H2,(H,14,15)

InChIKey

YNZJJMDTAFCBGO-UHFFFAOYSA-N

Compound name

2-piperidin-1-ylpyridine-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 48
Patents: 206.10553 Da
Monoisotopic Mass: 1.7
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]+	207.11281	146.4
[M+Na]+	229.09475	158.4
[M+NH4]+	224.13935	153.8
[M+K]+	245.06869	152.7
[M-H]-	205.09825	148.4
[M+Na-2H]-	227.08020	153.1
[M]+	206.10498	148.4
[M]-	206.10608	148.4

Literature stripe

literature stripe

Patent stripe

patents stripe