CID 121215465

3-chloro-6-(oxetan-3-yloxy)pyridazine

Structural Information

Molecular Formula
C7H7ClN2O2
SMILES
C1C(CO1)OC2=NN=C(C=C2)Cl
InChI
InChI=1S/C7H7ClN2O2/c8-6-1-2-7(10-9-6)12-5-3-11-4-5/h1-2,5H,3-4H2
InChIKey
MCUNCIDDSZANLJ-UHFFFAOYSA-N
Compound name
3-chloro-6-(oxetan-3-yloxy)pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

186.0196 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.02688 127.4
[M+Na]+ 209.00882 137.6
[M+NH4]+ 204.05342 132.0
[M+K]+ 224.98276 133.8
[M-H]- 185.01232 128.3
[M+Na-2H]- 206.99427 133.3
[M]+ 186.01905 128.2
[M]- 186.02015 128.2
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