CID 455456

1,3-dipiperidinopropane

Structural Information

Molecular Formula

C₁₃H₂₆N₂

SMILES

C1CCN(CC1)CCCN2CCCCC2

InChI

InChI=1S/C13H26N2/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-13H2

InChIKey

AMBFNDRKYCJLNH-UHFFFAOYSA-N

Compound name

1-(3-piperidin-1-ylpropyl)piperidine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 4
References: 1069
Patents: 210.2096 Da
Monoisotopic Mass: 2.3
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]+	211.21688	154.7
[M+Na]+	233.19882	155.3
[M-H]-	209.20232	155.7
[M+NH4]+	228.24342	169.7
[M+K]+	249.17276	152.8
[M+H-H2O]+	193.20686	145.1
[M+HCOO]-	255.20780	167.9
[M+CH3COO]-	269.22345	186.6
[M+Na-2H]-	231.18427	156.9
[M]+	210.20905	145.6
[M]-	210.21015	145.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.