CID 9589230

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

Structural Information

Molecular Formula
C23H16ClN3O
SMILES
C1=CC=C(C=C1)/C=N/N2C(=N/C(=C\C3=CC=CC=C3Cl)/C2=O)C4=CC=CC=C4
InChI
InChI=1S/C23H16ClN3O/c24-20-14-8-7-13-19(20)15-21-23(28)27(25-16-17-9-3-1-4-10-17)22(26-21)18-11-5-2-6-12-18/h1-16H/b21-15-,25-16+
InChIKey
QVYJXOUHFPYMSR-ODYMTFIRSA-N
Compound name
(5Z)-3-[(E)-benzylideneamino]-5-[(2-chlorophenyl)methylidene]-2-phenylimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.09818 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.10546 193.6
[M+Na]+ 408.08740 211.4
[M+NH4]+ 403.13200 201.7
[M+K]+ 424.06134 201.8
[M-H]- 384.09090 202.0
[M+Na-2H]- 406.07285 205.8
[M]+ 385.09763 198.9
[M]- 385.09873 198.9
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.