CID 6991940

5-chloro-6-(4-chlorophenyl)-2-methylpyridazin-3(2h)-one

Structural Information

Molecular Formula
C11H8Cl2N2O
SMILES
CN1C(=O)C=C(C(=N1)C2=CC=C(C=C2)Cl)Cl
InChI
InChI=1S/C11H8Cl2N2O/c1-15-10(16)6-9(13)11(14-15)7-2-4-8(12)5-3-7/h2-6H,1H3
InChIKey
PCNKRULWWGCYNN-UHFFFAOYSA-N
Compound name
5-chloro-6-(4-chlorophenyl)-2-methylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.00137 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.008646 148.6
[M+Na]+ 276.990588 161.4
[M-H]- 252.994094 152.7
[M+NH4]+ 272.035193 164.8
[M+K]+ 292.964528 155.0
[M+H-H2O]+ 236.998630 141.4
[M+HCOO]- 298.999571 161.7
[M+CH3COO]- 313.015221 161.7
[M+Na-2H]- 274.976036 154.1
[M]+ 254.00082142 152.9
[M]- 254.00191858 152.9
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.