CID 6484144

4-(piperidin-1-yl)butan-1-amine

Structural Information

Molecular Formula

C₉H₂₀N₂

SMILES

C1CCN(CC1)CCCCN

InChI

InChI=1S/C9H20N2/c10-6-2-5-9-11-7-3-1-4-8-11/h1-10H2

InChIKey

ACOXURKIHJSMAC-UHFFFAOYSA-N

Compound name

4-piperidin-1-ylbutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 355
Patents: 156.16264 Da
Monoisotopic Mass: 0.9
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]+	157.169916	138.3
[M+Na]+	179.151858	141.7
[M-H]-	155.155364	138.6
[M+NH4]+	174.196463	157.1
[M+K]+	195.125798	140.0
[M+H-H2O]+	139.159900	131.3
[M+HCOO]-	201.160841	157.6
[M+CH3COO]-	215.176491	179.2
[M+Na-2H]-	177.137306	142.7
[M]+	156.16209142	132.6
[M]-	156.16318858	132.6

Literature stripe

literature stripe

Patent stripe

patents stripe