CID 566323

1-methyl-4-(methylamino)piperidine

Structural Information

Molecular Formula

C₇H₁₆N₂

SMILES

CNC1CCN(CC1)C

InChI

InChI=1S/C7H16N2/c1-8-7-3-5-9(2)6-4-7/h7-8H,3-6H2,1-2H3

InChIKey

XRYGCVVVDCEPRL-UHFFFAOYSA-N

Compound name

N,1-dimethylpiperidin-4-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 3320
Patents: 128.13135 Da
Monoisotopic Mass: 0.4
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]+	129.138626	128.8
[M+Na]+	151.120568	134.1
[M-H]-	127.124074	130.4
[M+NH4]+	146.165173	149.4
[M+K]+	167.094508	133.3
[M+H-H2O]+	111.128610	122.5
[M+HCOO]-	173.129551	149.4
[M+CH3COO]-	187.145201	174.9
[M+Na-2H]-	149.106016	134.7
[M]+	128.13080142	123.8
[M]-	128.13189858	123.8

Literature stripe

literature stripe

Patent stripe

patents stripe