CID 504014

559208-67-2

Structural Information

Molecular Formula
C5H8N2O4
SMILES
C1C(C(=O)N(O1)CC(=O)O)N
InChI
InChI=1S/C5H8N2O4/c6-3-2-11-7(5(3)10)1-4(8)9/h3H,1-2,6H2,(H,8,9)
InChIKey
BLNMVEHKBXUWAG-UHFFFAOYSA-N
Compound name
2-(4-amino-3-oxo-1,2-oxazolidin-2-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

160.0484 Da
Monoisotopic Mass

-4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.05568 130.0
[M+Na]+ 183.03762 137.5
[M-H]- 159.04112 131.3
[M+NH4]+ 178.08222 148.6
[M+K]+ 199.01156 137.9
[M+H-H2O]+ 143.04566 124.3
[M+HCOO]- 205.04660 150.5
[M+CH3COO]- 219.06225 174.2
[M+Na-2H]- 181.02307 133.2
[M]+ 160.04785 128.1
[M]- 160.04895 128.1
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.