CID 177800065

2954735-24-9

Structural Information

Molecular Formula
C7H9NO5
SMILES
C1CC(=O)NC(=O)C1OCC(=O)O
InChI
InChI=1S/C7H9NO5/c9-5-2-1-4(7(12)8-5)13-3-6(10)11/h4H,1-3H2,(H,10,11)(H,8,9,12)
InChIKey
CXIIKJXJIMUSNP-UHFFFAOYSA-N
Compound name
2-(2,6-dioxopiperidin-3-yl)oxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.04807 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.055346 135.7
[M+Na]+ 210.037288 142.1
[M-H]- 186.040794 134.9
[M+NH4]+ 205.081893 152.3
[M+K]+ 226.011228 140.8
[M+H-H2O]+ 170.045330 129.9
[M+HCOO]- 232.046271 152.8
[M+CH3COO]- 246.061921 175.1
[M+Na-2H]- 208.022736 138.6
[M]+ 187.04752142 132.6
[M]- 187.04861858 132.6
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.