CID 75136

Oxazolidine-2,5-dione

Structural Information

Molecular Formula
C3H3NO3
SMILES
C1C(=O)OC(=O)N1
InChI
InChI=1S/C3H3NO3/c5-2-1-4-3(6)7-2/h1H2,(H,4,6)
InChIKey
ARAFEULRMHFMDE-UHFFFAOYSA-N
Compound name
1,3-oxazolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2534
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 113.3
[M+Na]+ 124.00051 122.1
[M-H]- 100.00401 115.1
[M+NH4]+ 119.04511 134.8
[M+K]+ 139.97445 122.6
[M+H-H2O]+ 84.008550 108.4
[M+HCOO]- 146.00949 134.9
[M+CH3COO]- 160.02514 159.3
[M+Na-2H]- 121.98596 120.2
[M]+ 101.01074 111.4
[M]- 101.01184 111.4
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