CID 88087

19479-83-5

Structural Information

Molecular Formula

C₁₀H₂₂N₄

SMILES

C1CN(CCN1)CCN2CCNCC2

InChI

InChI=1S/C10H22N4/c1-5-13(6-2-11-1)9-10-14-7-3-12-4-8-14/h11-12H,1-10H2

InChIKey

XDHVNMPVLPEHND-UHFFFAOYSA-N

Compound name

1-(2-piperazin-1-ylethyl)piperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 762
Patents: 198.18445 Da
Monoisotopic Mass: -1.0
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]+	199.19173	152.4
[M+Na]+	221.17367	153.6
[M-H]-	197.17717	148.2
[M+NH4]+	216.21827	163.6
[M+K]+	237.14761	149.6
[M+H-H2O]+	181.18171	142.0
[M+HCOO]-	243.18265	160.8
[M+CH3COO]-	257.19830	159.2
[M+Na-2H]-	219.15912	155.1
[M]+	198.18390	139.7
[M]-	198.18500	139.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe