CID 504009

4-amino-2-(2-methoxyethyl)isoxazolidin-3-one

Structural Information

Molecular Formula
C6H12N2O3
SMILES
COCCN1C(=O)C(CO1)N
InChI
InChI=1S/C6H12N2O3/c1-10-3-2-8-6(9)5(7)4-11-8/h5H,2-4,7H2,1H3
InChIKey
FIGBFRFTCBWNRH-UHFFFAOYSA-N
Compound name
4-amino-2-(2-methoxyethyl)-1,2-oxazolidin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

160.0848 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.09208 132.0
[M+Na]+ 183.07402 139.6
[M-H]- 159.07752 134.4
[M+NH4]+ 178.11862 151.6
[M+K]+ 199.04796 140.3
[M+H-H2O]+ 143.08206 125.9
[M+HCOO]- 205.08300 154.3
[M+CH3COO]- 219.09865 177.4
[M+Na-2H]- 181.05947 136.3
[M]+ 160.08425 132.3
[M]- 160.08535 132.3
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.