CID 177843207

Dtxsid701369315

Structural Information

Molecular Formula
C21H11Cl3F2N2
SMILES
C1=CC(=CC=C1C2=C(N=C(N2)C3=C(C(=CC(=C3)Cl)Cl)Cl)C4=CC=C(C=C4)F)F
InChI
InChI=1S/C21H11Cl3F2N2/c22-13-9-16(18(24)17(23)10-13)21-27-19(11-1-5-14(25)6-2-11)20(28-21)12-3-7-15(26)8-4-12/h1-10H,(H,27,28)
InChIKey
WEPIYDMGQWKVEH-UHFFFAOYSA-N
Compound name
4,5-bis(4-fluorophenyl)-2-(2,3,5-trichlorophenyl)-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

433.99557 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.00285 195.0
[M+Na]+ 456.98479 207.8
[M-H]- 432.98829 199.7
[M+NH4]+ 452.02939 204.7
[M+K]+ 472.95873 196.5
[M+H-H2O]+ 416.99283 183.2
[M+HCOO]- 478.99377 198.4
[M+CH3COO]- 493.00942 203.5
[M+Na-2H]- 454.97024 191.8
[M]+ 433.99502 196.4
[M]- 433.99612 196.4
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.