CID 9584036

4-benzylidene-1-(benzylideneamino)-2-phenyl-2-imidazolin-5-one

Structural Information

Molecular Formula
C23H17N3O
SMILES
C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=N2)C3=CC=CC=C3)/N=C/C4=CC=CC=C4
InChI
InChI=1S/C23H17N3O/c27-23-21(16-18-10-4-1-5-11-18)25-22(20-14-8-3-9-15-20)26(23)24-17-19-12-6-2-7-13-19/h1-17H/b21-16-,24-17+
InChIKey
YTOZPDOTYJJSAD-GSTHOKQGSA-N
Compound name
(5Z)-5-benzylidene-3-[(E)-benzylideneamino]-2-phenylimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.13718 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.14446 185.3
[M+Na]+ 374.12640 192.6
[M-H]- 350.12990 196.5
[M+NH4]+ 369.17100 196.6
[M+K]+ 390.10034 184.8
[M+H-H2O]+ 334.13444 173.2
[M+HCOO]- 396.13538 209.0
[M+CH3COO]- 410.15103 195.7
[M+Na-2H]- 372.11185 188.0
[M]+ 351.13663 183.8
[M]- 351.13773 183.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.