CID 97389

2,4-oxazolidinedione

Structural Information

Molecular Formula
C3H3NO3
SMILES
C1C(=O)NC(=O)O1
InChI
InChI=1S/C3H3NO3/c5-2-1-7-3(6)4-2/h1H2,(H,4,5,6)
InChIKey
COWNFYYYZFRNOY-UHFFFAOYSA-N
Compound name
1,3-oxazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

5741
Patents

101.01129 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.01857 115.8
[M+Na]+ 124.00051 125.7
[M+NH4]+ 119.04511 123.0
[M+K]+ 139.97445 124.1
[M-H]- 100.00401 116.0
[M+Na-2H]- 121.98596 118.9
[M]+ 101.01074 116.8
[M]- 101.01184 116.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe