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: 574
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]+	115.12298	125.1
[M+Na]+	137.10492	129.3
[M-H]-	113.10842	125.0
[M+NH4]+	132.14952	145.1
[M+K]+	153.07886	127.9
[M+H-H2O]+	97.112960	118.9
[M+HCOO]-	159.11390	144.4
[M+CH3COO]-	173.12955	168.1
[M+Na-2H]-	135.09037	131.7
[M]+	114.11515	117.4
[M]-	114.11625	117.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe