CID 12455409

54151-70-1

Structural Information

Molecular Formula

C₈H₁₈N₂

SMILES

CC(CN)N1CCCCC1

InChI

InChI=1S/C8H18N2/c1-8(7-9)10-5-3-2-4-6-10/h8H,2-7,9H2,1H3

InChIKey

UNIIVAXJUCKZHT-UHFFFAOYSA-N

Compound name

2-piperidin-1-ylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 96
Patents: 142.147 Da
Monoisotopic Mass: 0.6
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]+	143.15428	134.5
[M+Na]+	165.13622	138.1
[M-H]-	141.13972	135.1
[M+NH4]+	160.18082	153.8
[M+K]+	181.11016	137.2
[M+H-H2O]+	125.14426	127.8
[M+HCOO]-	187.14520	153.1
[M+CH3COO]-	201.16085	177.0
[M+Na-2H]-	163.12167	138.2
[M]+	142.14645	127.8
[M]-	142.14755	127.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe