CID 6475271

(5e)-1-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-2-phenyl-5-[(e)-3-phenylprop-2-enylidene]imidazol-4-one

Structural Information

Molecular Formula
C28H26N2O2
SMILES
CC1=CC(=C(C=C1N2C(=C/C=C/C3=CC=CC=C3)C(=O)N=C2C4=CC=CC=C4)C(C)C)O
InChI
InChI=1S/C28H26N2O2/c1-19(2)23-18-25(20(3)17-26(23)31)30-24(16-10-13-21-11-6-4-7-12-21)28(32)29-27(30)22-14-8-5-9-15-22/h4-19,31H,1-3H3/b13-10+,24-16?
InChIKey
WPPWSNURFBNEPH-DARYBIDMSA-N
Compound name
1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-phenyl-5-[(E)-3-phenylprop-2-enylidene]imidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

422.19943 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.20671 207.4
[M+Na]+ 445.18865 214.6
[M-H]- 421.19215 216.5
[M+NH4]+ 440.23325 215.5
[M+K]+ 461.16259 205.7
[M+H-H2O]+ 405.19669 196.1
[M+HCOO]- 467.19763 224.5
[M+CH3COO]- 481.21328 215.6
[M+Na-2H]- 443.17410 202.9
[M]+ 422.19888 206.7
[M]- 422.19998 206.7
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.