CID 57461221

Methyl4-methyl-2-oxo-1,3-oxazolidine-4-carboxylate

Structural Information

Molecular Formula
C6H9NO4
SMILES
CC1(COC(=O)N1)C(=O)OC
InChI
InChI=1S/C6H9NO4/c1-6(4(8)10-2)3-11-5(9)7-6/h3H2,1-2H3,(H,7,9)
InChIKey
PCDLLYMSBKMVDS-UHFFFAOYSA-N
Compound name
methyl 4-methyl-2-oxo-1,3-oxazolidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

159.05316 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.06044 128.8
[M+Na]+ 182.04238 137.0
[M-H]- 158.04588 130.6
[M+NH4]+ 177.08698 150.0
[M+K]+ 198.01632 137.9
[M+H-H2O]+ 142.05042 124.5
[M+HCOO]- 204.05136 148.8
[M+CH3COO]- 218.06701 170.4
[M+Na-2H]- 180.02783 134.4
[M]+ 159.05261 129.1
[M]- 159.05371 129.1
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