CID 12449557

3-chloro-6-(2-chlorophenyl)pyridazine

Structural Information

Molecular Formula
C10H6Cl2N2
SMILES
C1=CC=C(C(=C1)C2=NN=C(C=C2)Cl)Cl
InChI
InChI=1S/C10H6Cl2N2/c11-8-4-2-1-3-7(8)9-5-6-10(12)14-13-9/h1-6H
InChIKey
UTCVANDFQGNDKQ-UHFFFAOYSA-N
Compound name
3-chloro-6-(2-chlorophenyl)pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

223.9908 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.998076 141.7
[M+Na]+ 246.980018 152.9
[M-H]- 222.983524 145.0
[M+NH4]+ 242.024623 158.5
[M+K]+ 262.953958 146.6
[M+H-H2O]+ 206.988060 134.2
[M+HCOO]- 268.989001 154.6
[M+CH3COO]- 283.004651 154.5
[M+Na-2H]- 244.965466 149.2
[M]+ 223.99025142 144.0
[M]- 223.99134858 144.0
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