CID 7138447

5-(piperidin-1-yl)pentan-1-amine

Structural Information

Molecular Formula

C₁₀H₂₂N₂

SMILES

C1CCN(CC1)CCCCCN

InChI

InChI=1S/C10H22N2/c11-7-3-1-4-8-12-9-5-2-6-10-12/h1-11H2

InChIKey

PXENHTLQNXTYRL-UHFFFAOYSA-N

Compound name

5-piperidin-1-ylpentan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 98
Patents: 170.1783 Da
Monoisotopic Mass: 1.2
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]+	171.18558	142.8
[M+Na]+	193.16752	145.7
[M-H]-	169.17102	142.8
[M+NH4]+	188.21212	161.0
[M+K]+	209.14146	143.8
[M+H-H2O]+	153.17556	135.5
[M+HCOO]-	215.17650	161.7
[M+CH3COO]-	229.19215	182.3
[M+Na-2H]-	191.15297	146.7
[M]+	170.17775	137.4
[M]-	170.17885	137.4

Literature stripe

literature stripe

Patent stripe

patents stripe