CID 307939

4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid

Structural Information

Molecular Formula
C5H7NO4
SMILES
CC1(COC(=O)N1)C(=O)O
InChI
InChI=1S/C5H7NO4/c1-5(3(7)8)2-10-4(9)6-5/h2H2,1H3,(H,6,9)(H,7,8)
InChIKey
UTUCVJYDXFKAKO-UHFFFAOYSA-N
Compound name
4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

145.0375 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.044776 125.3
[M+Na]+ 168.026718 133.3
[M-H]- 144.030224 125.7
[M+NH4]+ 163.071323 146.2
[M+K]+ 184.000658 133.5
[M+H-H2O]+ 128.034760 121.2
[M+HCOO]- 190.035701 143.9
[M+CH3COO]- 204.051351 165.5
[M+Na-2H]- 166.012166 130.8
[M]+ 145.03695142 123.3
[M]- 145.03804858 123.3
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