CID 43583893

3-chloro-6-(2,6-difluorophenyl)pyridazine

Structural Information

Molecular Formula
C10H5ClF2N2
SMILES
C1=CC(=C(C(=C1)F)C2=NN=C(C=C2)Cl)F
InChI
InChI=1S/C10H5ClF2N2/c11-9-5-4-8(14-15-9)10-6(12)2-1-3-7(10)13/h1-5H
InChIKey
NYBXZOPGMHOHGL-UHFFFAOYSA-N
Compound name
3-chloro-6-(2,6-difluorophenyl)pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.01093 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.01821 140.9
[M+Na]+ 249.00015 153.0
[M-H]- 225.00365 142.8
[M+NH4]+ 244.04475 157.5
[M+K]+ 264.97409 146.9
[M+H-H2O]+ 209.00819 131.4
[M+HCOO]- 271.00913 157.1
[M+CH3COO]- 285.02478 153.9
[M+Na-2H]- 246.98560 147.4
[M]+ 226.01038 140.6
[M]- 226.01148 140.6
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.