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

36
Patents

172.12119 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.128466 139.9
[M+Na]+ 195.110408 143.0
[M-H]- 171.113914 139.1
[M+NH4]+ 190.155013 156.9
[M+K]+ 211.084348 142.0
[M+H-H2O]+ 155.118450 133.2
[M+HCOO]- 217.119391 156.6
[M+CH3COO]- 231.135041 178.6
[M+Na-2H]- 193.095856 141.8
[M]+ 172.12064142 132.8
[M]- 172.12173858 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