CID 303563

2-amino-3-(piperidin-1-yl)propanoic acid dihydrochloride

Structural Information

Molecular Formula
C8H16N2O2
SMILES
C1CCN(CC1)CC(C(=O)O)N
InChI
InChI=1S/C8H16N2O2/c9-7(8(11)12)6-10-4-2-1-3-5-10/h7H,1-6,9H2,(H,11,12)
InChIKey
GUVRVXOFGFQXCS-UHFFFAOYSA-N
Compound name
2-amino-3-piperidin-1-ylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

172.12119 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 139.9
[M+Na]+ 195.11041 143.0
[M-H]- 171.11391 139.1
[M+NH4]+ 190.15501 156.9
[M+K]+ 211.08435 142.0
[M+H-H2O]+ 155.11845 133.2
[M+HCOO]- 217.11939 156.6
[M+CH3COO]- 231.13504 178.6
[M+Na-2H]- 193.09586 141.8
[M]+ 172.12064 132.8
[M]- 172.12174 132.8
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

patents stripe