CID 12449543

66549-62-0

Structural Information

Molecular Formula
C10H7FN2O
SMILES
C1=CC=C(C(=C1)C2=NNC(=O)C=C2)F
InChI
InChI=1S/C10H7FN2O/c11-8-4-2-1-3-7(8)9-5-6-10(14)13-12-9/h1-6H,(H,13,14)
InChIKey
AVFCWMCIFJSTAV-UHFFFAOYSA-N
Compound name
3-(2-fluorophenyl)-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

190.05424 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.06152 136.4
[M+Na]+ 213.04346 146.7
[M-H]- 189.04696 138.5
[M+NH4]+ 208.08806 152.7
[M+K]+ 229.01740 141.7
[M+H-H2O]+ 173.05150 127.6
[M+HCOO]- 235.05244 157.3
[M+CH3COO]- 249.06809 149.3
[M+Na-2H]- 211.02891 144.3
[M]+ 190.05369 133.7
[M]- 190.05479 133.7
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