CID 2723758

Piperazine-2-carboxylic acid

Structural Information

Molecular Formula

C₅H₁₀N₂O₂

SMILES

C1CNC(CN1)C(=O)O

InChI

InChI=1S/C5H10N2O2/c8-5(9)4-3-6-1-2-7-4/h4,6-7H,1-3H2,(H,8,9)

InChIKey

JSSXHAMIXJGYCS-UHFFFAOYSA-N

Compound name

piperazine-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 7
References: 3648
Patents: 130.07423 Da
Monoisotopic Mass: -3.5
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]+	131.08151	127.7
[M+Na]+	153.06345	136.2
[M+NH4]+	148.10805	134.0
[M+K]+	169.03739	132.8
[M-H]-	129.06695	125.8
[M+Na-2H]-	151.04890	130.4
[M]+	130.07368	127.7
[M]-	130.07478	127.7

Literature stripe

literature stripe

Patent stripe

patents stripe