CID 43167824

4-[2-(pyrrolidin-1-yl)ethoxy]piperidine

Structural Information

Molecular Formula

C₁₁H₂₂N₂O

SMILES

C1CCN(C1)CCOC2CCNCC2

InChI

InChI=1S/C11H22N2O/c1-2-8-13(7-1)9-10-14-11-3-5-12-6-4-11/h11-12H,1-10H2

InChIKey

IMQRZUQNVVBHHS-UHFFFAOYSA-N

Compound name

4-(2-pyrrolidin-1-ylethoxy)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 14
Patents: 198.17322 Da
Monoisotopic Mass: 0.7
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]+	199.180496	149.2
[M+Na]+	221.162438	151.2
[M-H]-	197.165944	149.6
[M+NH4]+	216.207043	165.9
[M+K]+	237.136378	148.9
[M+H-H2O]+	181.170480	140.5
[M+HCOO]-	243.171421	164.1
[M+CH3COO]-	257.187071	179.6
[M+Na-2H]-	219.147886	150.4
[M]+	198.17267142	141.3
[M]-	198.17376858	141.3

Literature stripe

literature stripe

Patent stripe

patents stripe