CID 3067297

2,4,4a,5-tetrahydro-7-fluoro-3h-indeno(1,2-c)pyridazin-3-one

Structural Information

Molecular Formula
C11H9FN2O
SMILES
C1C2CC(=O)NN=C2C3=C1C=C(C=C3)F
InChI
InChI=1S/C11H9FN2O/c12-8-1-2-9-6(4-8)3-7-5-10(15)13-14-11(7)9/h1-2,4,7H,3,5H2,(H,13,15)
InChIKey
HMQRUJRETYRCMY-UHFFFAOYSA-N
Compound name
7-fluoro-2,4,4a,5-tetrahydroindeno[1,2-c]pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.06989 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.07717 143.1
[M+Na]+ 227.05911 155.4
[M+NH4]+ 222.10371 151.5
[M+K]+ 243.03305 150.3
[M-H]- 203.06261 143.1
[M+Na-2H]- 225.04456 146.9
[M]+ 204.06934 144.6
[M]- 204.07044 144.6
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.