CID 22309159

1255666-24-0

Structural Information

Molecular Formula
C13H24N2O4
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)CC(C(=O)O)N
InChI
InChI=1S/C13H24N2O4/c1-13(2,3)19-12(18)15-6-4-9(5-7-15)8-10(14)11(16)17/h9-10H,4-8,14H2,1-3H3,(H,16,17)
InChIKey
JLCGFHQWQKGPIV-UHFFFAOYSA-N
Compound name
2-amino-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.1736 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.18088 163.9
[M+Na]+ 295.16282 169.1
[M+NH4]+ 290.20742 167.9
[M+K]+ 311.13676 167.9
[M-H]- 271.16632 161.4
[M+Na-2H]- 293.14827 163.7
[M]+ 272.17305 163.2
[M]- 272.17415 163.2
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.