CID 4292406

Methyl 2-oxo-1,3-oxazolidine-5-carboxylate

Structural Information

Molecular Formula
C5H7NO4
SMILES
COC(=O)C1CNC(=O)O1
InChI
InChI=1S/C5H7NO4/c1-9-4(7)3-2-6-5(8)10-3/h3H,2H2,1H3,(H,6,8)
InChIKey
YOAIRDDVWDKCTO-UHFFFAOYSA-N
Compound name
methyl 2-oxo-1,3-oxazolidine-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

145.0375 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.044776 125.8
[M+Na]+ 168.026718 133.5
[M-H]- 144.030224 127.4
[M+NH4]+ 163.071323 145.5
[M+K]+ 184.000658 134.4
[M+H-H2O]+ 128.034760 120.5
[M+HCOO]- 190.035701 146.0
[M+CH3COO]- 204.051351 167.8
[M+Na-2H]- 166.012166 130.5
[M]+ 145.03695142 125.3
[M]- 145.03804858 125.3
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