CID 73136

4,5-diphenyl-2h-imidazol-2-one

Structural Information

Molecular Formula
C15H10N2O
SMILES
C1=CC=C(C=C1)C2=NC(=O)N=C2C3=CC=CC=C3
InChI
InChI=1S/C15H10N2O/c18-15-16-13(11-7-3-1-4-8-11)14(17-15)12-9-5-2-6-10-12/h1-10H
InChIKey
OTLLZASEKLGFMH-UHFFFAOYSA-N
Compound name
4,5-diphenylimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

172
Patents

234.07932 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.086596 150.7
[M+Na]+ 257.068538 160.3
[M-H]- 233.072044 158.4
[M+NH4]+ 252.113143 167.1
[M+K]+ 273.042478 155.2
[M+H-H2O]+ 217.076580 141.4
[M+HCOO]- 279.077521 174.6
[M+CH3COO]- 293.093171 163.9
[M+Na-2H]- 255.053986 156.4
[M]+ 234.07877142 150.7
[M]- 234.07986858 150.7
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

patents stripe