CID 90880

Piperidin-3-ylmethanamine

Structural Information

Molecular Formula

C₆H₁₄N₂

SMILES

C1CC(CNC1)CN

InChI

InChI=1S/C6H14N2/c7-4-6-2-1-3-8-5-6/h6,8H,1-5,7H2

InChIKey

IPOVLZSJBYKHHU-UHFFFAOYSA-N

Compound name

piperidin-3-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1036
Patents: 114.1157 Da
Monoisotopic Mass: -0.4
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]+	115.12298	124.7
[M+Na]+	137.10492	134.1
[M+NH4]+	132.14952	133.4
[M+K]+	153.07886	128.5
[M-H]-	113.10842	126.3
[M+Na-2H]-	135.09037	129.7
[M]+	114.11515	126.1
[M]-	114.11625	126.1

Literature stripe

literature stripe

Patent stripe

patents stripe