CID 473225

(5e)-1-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-5-[(4-methoxyphenyl)methylene]-2-methyl-imidazol-4-one

Structural Information

Molecular Formula
C22H24N2O3
SMILES
CC1=CC(=C(C=C1N2C(=NC(=O)C2=CC3=CC=C(C=C3)OC)C)C(C)C)O
InChI
InChI=1S/C22H24N2O3/c1-13(2)18-12-19(14(3)10-21(18)25)24-15(4)23-22(26)20(24)11-16-6-8-17(27-5)9-7-16/h6-13,25H,1-5H3
InChIKey
VNQPADDECSEHFN-UHFFFAOYSA-N
Compound name
1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-5-[(4-methoxyphenyl)methylidene]-2-methylimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.17868 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.18596 188.9
[M+Na]+ 387.16790 198.0
[M-H]- 363.17140 195.9
[M+NH4]+ 382.21250 200.5
[M+K]+ 403.14184 192.2
[M+H-H2O]+ 347.17594 179.8
[M+HCOO]- 409.17688 206.9
[M+CH3COO]- 423.19253 218.2
[M+Na-2H]- 385.15335 184.9
[M]+ 364.17813 191.6
[M]- 364.17923 191.6
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.