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
5
Annotation Hits

7
References

4915
Patents

130.07423 Da
Monoisotopic Mass

-3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.081506 128.4
[M+Na]+ 153.063448 133.1
[M-H]- 129.066954 124.3
[M+NH4]+ 148.108053 145.0
[M+K]+ 169.037388 130.8
[M+H-H2O]+ 113.071490 122.1
[M+HCOO]- 175.072431 142.3
[M+CH3COO]- 189.088081 162.0
[M+Na-2H]- 151.048896 132.8
[M]+ 130.07368142 119.4
[M]- 130.07477858 119.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe