CID 5139788

74181-31-0

Structural Information

Molecular Formula
C18H18N2
SMILES
CCCC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H18N2/c1-2-9-16-19-17(14-10-5-3-6-11-14)18(20-16)15-12-7-4-8-13-15/h3-8,10-13H,2,9H2,1H3,(H,19,20)
InChIKey
HYQVIXGSNDUWKE-UHFFFAOYSA-N
Compound name
4,5-diphenyl-2-propyl-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

262.147 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.15428 161.9
[M+Na]+ 285.13622 169.6
[M-H]- 261.13972 167.7
[M+NH4]+ 280.18082 176.7
[M+K]+ 301.11016 162.9
[M+H-H2O]+ 245.14426 152.4
[M+HCOO]- 307.14520 183.0
[M+CH3COO]- 321.16085 173.2
[M+Na-2H]- 283.12167 165.7
[M]+ 262.14645 160.5
[M]- 262.14755 160.5
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