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

70
Patents

272.1372 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.144476 161.2
[M+Na]+ 295.126418 165.4
[M-H]- 271.129924 161.4
[M+NH4]+ 290.171023 175.1
[M+K]+ 311.100358 164.9
[M+H-H2O]+ 255.134460 154.9
[M+HCOO]- 317.135401 176.7
[M+CH3COO]- 331.151051 197.1
[M+Na-2H]- 293.111866 162.4
[M]+ 272.13665142 159.7
[M]- 272.13774858 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