CID 9589235

4-(o-chlorobenzylidene)-1-((p-chlorobenzylidene)amino)-2-phenyl-2-imidazolin-5-one

Structural Information

Molecular Formula
C23H15Cl2N3O
SMILES
C1=CC=C(C=C1)C2=N/C(=C\C3=CC=CC=C3Cl)/C(=O)N2/N=C/C4=CC=C(C=C4)Cl
InChI
InChI=1S/C23H15Cl2N3O/c24-19-12-10-16(11-13-19)15-26-28-22(17-6-2-1-3-7-17)27-21(23(28)29)14-18-8-4-5-9-20(18)25/h1-15H/b21-14-,26-15+
InChIKey
VUIRSKNZZMNLKR-IKCALLGASA-N
Compound name
(5Z)-5-[(2-chlorophenyl)methylidene]-3-[(E)-(4-chlorophenyl)methylideneamino]-2-phenylimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

419.0592 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.06648 200.0
[M+Na]+ 442.04842 218.6
[M+NH4]+ 437.09302 208.2
[M+K]+ 458.02236 208.4
[M-H]- 418.05192 208.2
[M+Na-2H]- 440.03387 211.6
[M]+ 419.05865 205.8
[M]- 419.05975 205.8
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.