CID 3063362

3(2h)-pyridazinone, 4,5-dichloro-2-(2-(1-piperidinyl)ethyl)-, monohydrochloride

Structural Information

Molecular Formula
C11H15Cl2N3O
SMILES
C1CCN(CC1)CCN2C(=O)C(=C(C=N2)Cl)Cl
InChI
InChI=1S/C11H15Cl2N3O/c12-9-8-14-16(11(17)10(9)13)7-6-15-4-2-1-3-5-15/h8H,1-7H2
InChIKey
IGYZZUIZNBYTLN-UHFFFAOYSA-N
Compound name
4,5-dichloro-2-(2-piperidin-1-ylethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.0592 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.06648 158.4
[M+Na]+ 298.04842 167.0
[M-H]- 274.05192 159.4
[M+NH4]+ 293.09302 171.6
[M+K]+ 314.02236 161.1
[M+H-H2O]+ 258.05646 149.5
[M+HCOO]- 320.05740 165.7
[M+CH3COO]- 334.07305 195.2
[M+Na-2H]- 296.03387 161.3
[M]+ 275.05865 158.1
[M]- 275.05975 158.1
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.