CID 3023044

2-phenyl-1-(2,4,6-trimethylbenzoyl)-1h-imidazole

Structural Information

Molecular Formula
C19H18N2O
SMILES
CC1=CC(=C(C(=C1)C)C(=O)N2C=CN=C2C3=CC=CC=C3)C
InChI
InChI=1S/C19H18N2O/c1-13-11-14(2)17(15(3)12-13)19(22)21-10-9-20-18(21)16-7-5-4-6-8-16/h4-12H,1-3H3
InChIKey
MGNFFUHBTQWOSG-UHFFFAOYSA-N
Compound name
(2-phenylimidazol-1-yl)-(2,4,6-trimethylphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

214
Patents

290.1419 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.149176 169.0
[M+Na]+ 313.131118 178.5
[M-H]- 289.134624 177.1
[M+NH4]+ 308.175723 183.9
[M+K]+ 329.105058 173.0
[M+H-H2O]+ 273.139160 159.6
[M+HCOO]- 335.140101 190.6
[M+CH3COO]- 349.155751 181.1
[M+Na-2H]- 311.116566 170.0
[M]+ 290.14135142 170.7
[M]- 290.14244858 170.7
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

patents stripe