CID 5273075

7-fluoro-2-(4-fluorophenyl)-5h-pyrazolo[4,3-c]quinolin-3-one

Structural Information

Molecular Formula
C16H9F2N3O
SMILES
C1=CC(=CC=C1N2C(=O)C3=CN=C4C=C(C=CC4=C3N2)F)F
InChI
InChI=1S/C16H9F2N3O/c17-9-1-4-11(5-2-9)21-16(22)13-8-19-14-7-10(18)3-6-12(14)15(13)20-21/h1-8,20H
InChIKey
HFYGBGOITHOWMI-UHFFFAOYSA-N
Compound name
7-fluoro-2-(4-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

297.07138 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.07866 165.0
[M+Na]+ 320.06060 179.0
[M-H]- 296.06410 167.4
[M+NH4]+ 315.10520 179.8
[M+K]+ 336.03454 170.4
[M+H-H2O]+ 280.06864 154.1
[M+HCOO]- 342.06958 183.0
[M+CH3COO]- 356.08523 176.7
[M+Na-2H]- 318.04605 170.4
[M]+ 297.07083 164.9
[M]- 297.07193 164.9
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.