CID 307939

958795-22-7

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]+ 146.04478 125.3
[M+Na]+ 168.02672 133.3
[M-H]- 144.03022 125.7
[M+NH4]+ 163.07132 146.2
[M+K]+ 184.00066 133.5
[M+H-H2O]+ 128.03476 121.2
[M+HCOO]- 190.03570 143.9
[M+CH3COO]- 204.05135 165.5
[M+Na-2H]- 166.01217 130.8
[M]+ 145.03695 123.3
[M]- 145.03805 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