CID 15401908

1,4-dichloro-6,7-dihydro-5h-cyclopenta[d]pyridazine

Structural Information

Molecular Formula
C7H6Cl2N2
SMILES
C1CC2=C(C1)C(=NN=C2Cl)Cl
InChI
InChI=1S/C7H6Cl2N2/c8-6-4-2-1-3-5(4)7(9)11-10-6/h1-3H2
InChIKey
OCPOKZIBPKWKKF-UHFFFAOYSA-N
Compound name
1,4-dichloro-6,7-dihydro-5H-cyclopenta[d]pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

187.9908 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.99808 132.6
[M+Na]+ 210.98002 147.7
[M+NH4]+ 206.02462 142.7
[M+K]+ 226.95396 141.3
[M-H]- 186.98352 134.4
[M+Na-2H]- 208.96547 139.4
[M]+ 187.99025 135.9
[M]- 187.99135 135.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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Patent stripe

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