CID 15670691

3-(methylamino)piperidine dihydrochloride

Structural Information

Molecular Formula

C₆H₁₄N₂

SMILES

CNC1CCCNC1

InChI

InChI=1S/C6H14N2/c1-7-6-3-2-4-8-5-6/h6-8H,2-5H2,1H3

InChIKey

LJAXTAOSOVPBQH-UHFFFAOYSA-N

Compound name

N-methylpiperidin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 601
Patents: 114.1157 Da
Monoisotopic Mass: -0.1
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]+	115.122976	125.1
[M+Na]+	137.104918	129.3
[M-H]-	113.108424	125.0
[M+NH4]+	132.149523	145.1
[M+K]+	153.078858	127.9
[M+H-H2O]+	97.112960	118.9
[M+HCOO]-	159.113901	144.4
[M+CH3COO]-	173.129551	168.1
[M+Na-2H]-	135.090366	131.7
[M]+	114.11515142	117.4
[M]-	114.11624858	117.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe