CID 120474

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

Structural Information

Molecular Formula
C10H15Cl2N3O
SMILES
CCN(CC)CCN1C(=O)C(=C(C=N1)Cl)Cl
InChI
InChI=1S/C10H15Cl2N3O/c1-3-14(4-2)5-6-15-10(16)9(12)8(11)7-13-15/h7H,3-6H2,1-2H3
InChIKey
FQLCBPGVJBJNJW-UHFFFAOYSA-N
Compound name
4,5-dichloro-2-[2-(diethylamino)ethyl]pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

263.0592 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.06648 154.3
[M+Na]+ 286.04842 164.5
[M-H]- 262.05192 156.1
[M+NH4]+ 281.09302 170.6
[M+K]+ 302.02236 160.1
[M+H-H2O]+ 246.05646 147.6
[M+HCOO]- 308.05740 167.9
[M+CH3COO]- 322.07305 200.9
[M+Na-2H]- 284.03387 158.2
[M]+ 263.05865 160.7
[M]- 263.05975 160.7
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