CID 6448393

Brn 4584503

Structural Information

Molecular Formula
C26H23N3O2
SMILES
C1COCCN1C2=CC=C(C=C2)N3C(=N/C(=C\C4=CC=CC=C4)/C3=O)C5=CC=CC=C5
InChI
InChI=1S/C26H23N3O2/c30-26-24(19-20-7-3-1-4-8-20)27-25(21-9-5-2-6-10-21)29(26)23-13-11-22(12-14-23)28-15-17-31-18-16-28/h1-14,19H,15-18H2/b24-19-
InChIKey
MXRXMJJOFYVYEI-CLCOLTQESA-N
Compound name
(5Z)-5-benzylidene-3-(4-morpholin-4-ylphenyl)-2-phenylimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.17902 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.18630 201.6
[M+Na]+ 432.16824 206.7
[M-H]- 408.17174 212.8
[M+NH4]+ 427.21284 206.7
[M+K]+ 448.14218 199.5
[M+H-H2O]+ 392.17628 187.8
[M+HCOO]- 454.17722 216.0
[M+CH3COO]- 468.19287 209.0
[M+Na-2H]- 430.15369 200.0
[M]+ 409.17847 196.3
[M]- 409.17957 196.3
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.