CID 487071

1-[2-phenyl-2-[(4-phenylphenyl)methoxy]ethyl]imidazole

Structural Information

Molecular Formula
C24H22N2O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)COC(CN3C=CN=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H22N2O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-27-24(17-26-16-15-25-19-26)23-9-5-2-6-10-23/h1-16,19,24H,17-18H2
InChIKey
NQHQEGNSAJZPTA-UHFFFAOYSA-N
Compound name
1-[2-phenyl-2-[(4-phenylphenyl)methoxy]ethyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

354.17322 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.18050 186.3
[M+Na]+ 377.16244 191.2
[M-H]- 353.16594 195.4
[M+NH4]+ 372.20704 196.5
[M+K]+ 393.13638 184.5
[M+H-H2O]+ 337.17048 174.1
[M+HCOO]- 399.17142 206.8
[M+CH3COO]- 413.18707 195.5
[M+Na-2H]- 375.14789 188.8
[M]+ 354.17267 185.9
[M]- 354.17377 185.9
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

No patent data available for this compound.