CID 487074

Schembl11495874

Structural Information

Molecular Formula
C24H20Cl2N2O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)COC(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl
InChI
InChI=1S/C24H20Cl2N2O/c25-21-10-11-22(23(26)14-21)24(15-28-13-12-27-17-28)29-16-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-14,17,24H,15-16H2
InChIKey
UOPYUOMFMOGFLM-UHFFFAOYSA-N
Compound name
1-[2-(2,4-dichlorophenyl)-2-[(4-phenylphenyl)methoxy]ethyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

422.09528 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.10256 200.3
[M+Na]+ 445.08450 208.2
[M-H]- 421.08800 208.9
[M+NH4]+ 440.12910 209.8
[M+K]+ 461.05844 199.2
[M+H-H2O]+ 405.09254 188.5
[M+HCOO]- 467.09348 210.9
[M+CH3COO]- 481.10913 208.9
[M+Na-2H]- 443.06995 199.8
[M]+ 422.09473 204.7
[M]- 422.09583 204.7
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.