CID 83275

4-(2-aminoethyl)pyridine

Structural Information

Molecular Formula

C₇H₁₀N₂

SMILES

C1=CN=CC=C1CCN

InChI

InChI=1S/C7H10N2/c8-4-1-7-2-5-9-6-3-7/h2-3,5-6H,1,4,8H2

InChIKey

IDLHTECVNDEOIY-UHFFFAOYSA-N

Compound name

2-pyridin-4-ylethanamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 4
References: 5156
Patents: 122.0844 Da
Monoisotopic Mass: 0.0
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]+	123.091676	123.4
[M+Na]+	145.073618	130.9
[M-H]-	121.077124	125.2
[M+NH4]+	140.118223	143.9
[M+K]+	161.047558	129.0
[M+H-H2O]+	105.081660	117.0
[M+HCOO]-	167.082601	147.8
[M+CH3COO]-	181.098251	172.0
[M+Na-2H]-	143.059066	132.2
[M]+	122.08385142	121.4
[M]-	122.08494858	121.4

Literature stripe

literature stripe

Patent stripe

patents stripe