CID 147392

Piperazin-1-amine

Structural Information

Molecular Formula

C₄H₁₁N₃

SMILES

C1CN(CCN1)N

InChI

InChI=1S/C4H11N3/c5-7-3-1-6-2-4-7/h6H,1-5H2

InChIKey

IYPZRUYMFDWKSS-UHFFFAOYSA-N

Compound name

piperazin-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 38
References: 2668
Patents: 101.0953 Da
Monoisotopic Mass: -1.1
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]+	102.10258	120.1
[M+Na]+	124.08452	129.7
[M+NH4]+	119.12912	128.2
[M+K]+	140.05846	124.7
[M-H]-	100.08802	120.9
[M+Na-2H]-	122.06997	125.1
[M]+	101.09475	121.3
[M]-	101.09585	121.3

Literature stripe

literature stripe

Patent stripe

patents stripe