CID 3061055

3(2h)-pyridazinone, 4-acetyl-5,6-bis(4-chlorophenyl)-2-methyl-

Structural Information

Molecular Formula
C19H14Cl2N2O2
SMILES
CC(=O)C1=C(C(=NN(C1=O)C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H14Cl2N2O2/c1-11(24)16-17(12-3-7-14(20)8-4-12)18(22-23(2)19(16)25)13-5-9-15(21)10-6-13/h3-10H,1-2H3
InChIKey
FVUWJVCWXIWHGX-UHFFFAOYSA-N
Compound name
4-acetyl-5,6-bis(4-chlorophenyl)-2-methylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.04324 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.05052 184.1
[M+Na]+ 395.03246 203.7
[M+NH4]+ 390.07706 191.9
[M+K]+ 411.00640 193.9
[M-H]- 371.03596 189.8
[M+Na-2H]- 393.01791 194.6
[M]+ 372.04269 189.4
[M]- 372.04379 189.4
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.