CID 97769

4-ethyl-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C5H9NO2
SMILES
CCC1COC(=O)N1
InChI
InChI=1S/C5H9NO2/c1-2-4-3-8-5(7)6-4/h4H,2-3H2,1H3,(H,6,7)
InChIKey
CRHQYASHOICRND-UHFFFAOYSA-N
Compound name
4-ethyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

209
Patents

115.06333 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 122.1
[M+Na]+ 138.05255 132.1
[M+NH4]+ 133.09715 129.8
[M+K]+ 154.02649 129.6
[M-H]- 114.05605 123.0
[M+Na-2H]- 136.03800 125.3
[M]+ 115.06278 123.4
[M]- 115.06388 123.4
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

patents stripe