CID 504013

Methyl 2-(4-amino-3-oxo-isoxazolidin-2-yl)acetate

Structural Information

Molecular Formula
C6H10N2O4
SMILES
COC(=O)CN1C(=O)C(CO1)N
InChI
InChI=1S/C6H10N2O4/c1-11-5(9)2-8-6(10)4(7)3-12-8/h4H,2-3,7H2,1H3
InChIKey
WEGJOPUUSHOIOR-UHFFFAOYSA-N
Compound name
methyl 2-(4-amino-3-oxo-1,2-oxazolidin-2-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

174.06406 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.071336 134.0
[M+Na]+ 197.053278 141.6
[M-H]- 173.056784 136.6
[M+NH4]+ 192.097883 152.9
[M+K]+ 213.027218 142.7
[M+H-H2O]+ 157.061320 128.0
[M+HCOO]- 219.062261 155.7
[M+CH3COO]- 233.077911 179.0
[M+Na-2H]- 195.038726 137.2
[M]+ 174.06351142 134.3
[M]- 174.06460858 134.3
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

No patent data available for this compound.