CID 3149263

2-(2-methylpiperidin-1-yl)ethan-1-amine

Structural Information

Molecular Formula

C₈H₁₈N₂

SMILES

CC1CCCCN1CCN

InChI

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

InChIKey

DBSDZVMWEMKFCH-UHFFFAOYSA-N

Compound name

2-(2-methylpiperidin-1-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 78
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]+	143.154276	133.9
[M+Na]+	165.136218	138.7
[M-H]-	141.139724	134.8
[M+NH4]+	160.180823	153.6
[M+K]+	181.110158	137.3
[M+H-H2O]+	125.144260	127.4
[M+HCOO]-	187.145201	153.5
[M+CH3COO]-	201.160851	177.3
[M+Na-2H]-	163.121666	138.1
[M]+	142.14645142	128.2
[M]-	142.14754858	128.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe