CID 3073044

1h,3h-difuro(3,4-b:3',4'-e)pyridine-1,7(4h)-dione, 5,8-dihydro-8-(2-fluorophenyl)-

Structural Information

Molecular Formula
C15H10FNO4
SMILES
C1C2=C(C(C3=C(N2)COC3=O)C4=CC=CC=C4F)C(=O)O1
InChI
InChI=1S/C15H10FNO4/c16-8-4-2-1-3-7(8)11-12-9(5-20-14(12)18)17-10-6-21-15(19)13(10)11/h1-4,11,17H,5-6H2
InChIKey
FDCAAZYUYPBMFJ-UHFFFAOYSA-N
Compound name
8-(2-fluorophenyl)-5,11-dioxa-2-azatricyclo[7.3.0.03,7]dodeca-1(9),3(7)-diene-6,10-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

287.0594 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.06668 163.7
[M+Na]+ 310.04862 175.5
[M+NH4]+ 305.09322 170.8
[M+K]+ 326.02256 173.9
[M-H]- 286.05212 167.2
[M+Na-2H]- 308.03407 165.2
[M]+ 287.05885 166.1
[M]- 287.05995 166.1
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