CID 62786307

1-(azetidin-3-yl)-4-ethylpiperazine trihydrochloride

Structural Information

Molecular Formula

C₉H₁₉N₃

SMILES

CCN1CCN(CC1)C2CNC2

InChI

InChI=1S/C9H19N3/c1-2-11-3-5-12(6-4-11)9-7-10-8-9/h9-10H,2-8H2,1H3

InChIKey

GFDHXJSILDAMHC-UHFFFAOYSA-N

Compound name

1-(azetidin-3-yl)-4-ethylpiperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 169.1579 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]+	170.16518	140.2
[M+Na]+	192.14712	146.1
[M+NH4]+	187.19172	143.9
[M+K]+	208.12106	142.2
[M-H]-	168.15062	138.7
[M+Na-2H]-	190.13257	142.6
[M]+	169.15735	139.1
[M]-	169.15845	139.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe