CID 535780

1-ethyl-4-(piperidin-4-yl)piperazine trihydrochloride

Structural Information

Molecular Formula

C₁₁H₂₃N₃

SMILES

CCN1CCN(CC1)C2CCNCC2

InChI

InChI=1S/C11H23N3/c1-2-13-7-9-14(10-8-13)11-3-5-12-6-4-11/h11-12H,2-10H2,1H3

InChIKey

JOXMSOKQNJLNEN-UHFFFAOYSA-N

Compound name

1-ethyl-4-piperidin-4-ylpiperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 108
Patents: 197.1892 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]+	198.19648	151.2
[M+Na]+	220.17842	161.4
[M+NH4]+	215.22302	159.1
[M+K]+	236.15236	154.6
[M-H]-	196.18192	153.2
[M+Na-2H]-	218.16387	155.9
[M]+	197.18865	152.9
[M]-	197.18975	152.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe