CID 65586165

4-(4-bromo-2-fluorophenyl)-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C9H7BrFNO2
SMILES
C1C(NC(=O)O1)C2=C(C=C(C=C2)Br)F
InChI
InChI=1S/C9H7BrFNO2/c10-5-1-2-6(7(11)3-5)8-4-14-9(13)12-8/h1-3,8H,4H2,(H,12,13)
InChIKey
FHPOSFDLHDOEIS-UHFFFAOYSA-N
Compound name
4-(4-bromo-2-fluorophenyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.96442 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.97170 148.4
[M+Na]+ 281.95364 160.6
[M-H]- 257.95714 154.8
[M+NH4]+ 276.99824 167.6
[M+K]+ 297.92758 149.9
[M+H-H2O]+ 241.96168 147.6
[M+HCOO]- 303.96262 165.9
[M+CH3COO]- 317.97827 187.2
[M+Na-2H]- 279.93909 153.0
[M]+ 258.96387 164.0
[M]- 258.96497 164.0
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

No patent data available for this compound.