CID 62211827

4-[3-(pyrrolidin-1-yl)propyl]piperidine

Structural Information

Molecular Formula

C₁₂H₂₄N₂

SMILES

C1CCN(C1)CCCC2CCNCC2

InChI

InChI=1S/C12H24N2/c1-2-10-14(9-1)11-3-4-12-5-7-13-8-6-12/h12-13H,1-11H2

InChIKey

RSYRVTHYFRNCSH-UHFFFAOYSA-N

Compound name

4-(3-pyrrolidin-1-ylpropyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 196.19395 Da
Monoisotopic Mass: 1.8
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]+	197.20123	150.8
[M+Na]+	219.18317	152.4
[M-H]-	195.18667	151.0
[M+NH4]+	214.22777	167.6
[M+K]+	235.15711	149.4
[M+H-H2O]+	179.19121	142.0
[M+HCOO]-	241.19215	165.1
[M+CH3COO]-	255.20780	180.6
[M+Na-2H]-	217.16862	151.4
[M]+	196.19340	141.8
[M]-	196.19450	141.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe