CID 254290

81310-55-6

Structural Information

Molecular Formula

C₁₁H₂₂N₂

SMILES

C1CCN(CC1)CC2CCCCN2

InChI

InChI=1S/C11H22N2/c1-4-8-13(9-5-1)10-11-6-2-3-7-12-11/h11-12H,1-10H2

InChIKey

QYKGBJGIKHJGFR-UHFFFAOYSA-N

Compound name

1-(piperidin-2-ylmethyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 118
Patents: 182.1783 Da
Monoisotopic Mass: 1.6
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]+	183.18558	146.4
[M+Na]+	205.16752	147.6
[M-H]-	181.17102	146.5
[M+NH4]+	200.21212	161.9
[M+K]+	221.14146	144.6
[M+H-H2O]+	165.17556	137.6
[M+HCOO]-	227.17650	158.9
[M+CH3COO]-	241.19215	178.0
[M+Na-2H]-	203.15297	149.3
[M]+	182.17775	134.9
[M]-	182.17885	134.9

Literature stripe

literature stripe

Patent stripe

patents stripe