CID 49768231

6-fluoro-3-(3-fluorophenyl)-1,3-benzoxazine-2,4-dione

Structural Information

Molecular Formula
C14H7F2NO3
SMILES
C1=CC(=CC(=C1)F)N2C(=O)C3=C(C=CC(=C3)F)OC2=O
InChI
InChI=1S/C14H7F2NO3/c15-8-2-1-3-10(6-8)17-13(18)11-7-9(16)4-5-12(11)20-14(17)19/h1-7H
InChIKey
KFALZCNOLJBSOY-UHFFFAOYSA-N
Compound name
6-fluoro-3-(3-fluorophenyl)-1,3-benzoxazine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

275.0394 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.04668 155.2
[M+Na]+ 298.02862 168.6
[M-H]- 274.03212 161.2
[M+NH4]+ 293.07322 170.3
[M+K]+ 314.00256 164.4
[M+H-H2O]+ 258.03666 145.1
[M+HCOO]- 320.03760 175.9
[M+CH3COO]- 334.05325 168.7
[M+Na-2H]- 296.01407 162.1
[M]+ 275.03885 156.9
[M]- 275.03995 156.9
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.