CID 2763980

241816-11-5

Structural Information

Molecular Formula

C₁₁H₁₄N₂O

SMILES

C1CCN(CC1)C2=NC=C(C=C2)C=O

InChI

InChI=1S/C11H14N2O/c14-9-10-4-5-11(12-8-10)13-6-2-1-3-7-13/h4-5,8-9H,1-3,6-7H2

InChIKey

RKIMIISNVCLRLA-UHFFFAOYSA-N

Compound name

6-piperidin-1-ylpyridine-3-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 90
Patents: 190.11061 Da
Monoisotopic Mass: 1.6
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]+	191.11789	142.2
[M+Na]+	213.09983	148.2
[M-H]-	189.10333	145.2
[M+NH4]+	208.14443	158.5
[M+K]+	229.07377	145.2
[M+H-H2O]+	173.10787	133.4
[M+HCOO]-	235.10881	161.0
[M+CH3COO]-	249.12446	181.7
[M+Na-2H]-	211.08528	148.1
[M]+	190.11006	137.9
[M]-	190.11116	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe