CID 2756488

315717-76-1

Structural Information

Molecular Formula

C₁₄H₂₀N₂O₂

SMILES

C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)CN

InChI

InChI=1S/C14H20N2O2/c15-9-13-7-4-8-16(10-13)14(17)18-11-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11,15H2

InChIKey

PAIJQGYSIGOWOF-UHFFFAOYSA-N

Compound name

benzyl 3-(aminomethyl)piperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 74
Patents: 248.15248 Da
Monoisotopic Mass: 1.4
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]+	249.15976	159.3
[M+Na]+	271.14170	169.8
[M+NH4]+	266.18630	166.7
[M+K]+	287.11564	163.5
[M-H]-	247.14520	162.6
[M+Na-2H]-	269.12715	165.4
[M]+	248.15193	161.4
[M]-	248.15303	161.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe