CID 19352050

733049-29-1

Structural Information

Molecular Formula
C12H20N2O5
SMILES
CC(C)(C)OC(=O)NC1CCCN(C1=O)CC(=O)O
InChI
InChI=1S/C12H20N2O5/c1-12(2,3)19-11(18)13-8-5-4-6-14(10(8)17)7-9(15)16/h8H,4-7H2,1-3H3,(H,13,18)(H,15,16)
InChIKey
GLPLDJICXMMSBB-UHFFFAOYSA-N
Compound name
2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxopiperidin-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

272.1372 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.14448 161.2
[M+Na]+ 295.12642 165.4
[M-H]- 271.12992 161.4
[M+NH4]+ 290.17102 175.1
[M+K]+ 311.10036 164.9
[M+H-H2O]+ 255.13446 154.9
[M+HCOO]- 317.13540 176.7
[M+CH3COO]- 331.15105 197.1
[M+Na-2H]- 293.11187 162.4
[M]+ 272.13665 159.7
[M]- 272.13775 159.7
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