CID 61242816

4-(piperazin-1-yl)piperidine-4-carboxylic acid

Structural Information

Molecular Formula
C10H19N3O2
SMILES
C1CNCCC1(C(=O)O)N2CCNCC2
InChI
InChI=1S/C10H19N3O2/c14-9(15)10(1-3-11-4-2-10)13-7-5-12-6-8-13/h11-12H,1-8H2,(H,14,15)
InChIKey
HPYAUWCUNUYIDG-UHFFFAOYSA-N
Compound name
4-piperazin-1-ylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.14772 Da
Monoisotopic Mass

-3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15500 153.4
[M+Na]+ 236.13694 155.2
[M-H]- 212.14044 150.0
[M+NH4]+ 231.18154 166.6
[M+K]+ 252.11088 151.8
[M+H-H2O]+ 196.14498 145.1
[M+HCOO]- 258.14592 161.5
[M+CH3COO]- 272.16157 176.8
[M+Na-2H]- 234.12239 155.8
[M]+ 213.14717 140.4
[M]- 213.14827 140.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.