CID 57488730

4-(fluoromethyl)-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C4H6FNO2
SMILES
C1C(NC(=O)O1)CF
InChI
InChI=1S/C4H6FNO2/c5-1-3-2-8-4(7)6-3/h3H,1-2H2,(H,6,7)
InChIKey
FNZXXGGFJFIORC-UHFFFAOYSA-N
Compound name
4-(fluoromethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

119.03825 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.04553 118.8
[M+Na]+ 142.02747 127.0
[M-H]- 118.03097 119.0
[M+NH4]+ 137.07207 139.7
[M+K]+ 158.00141 126.9
[M+H-H2O]+ 102.03551 112.8
[M+HCOO]- 164.03645 138.7
[M+CH3COO]- 178.05210 163.9
[M+Na-2H]- 140.01292 124.5
[M]+ 119.03770 115.3
[M]- 119.03880 115.3
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