CID 2378

Bifonazole

Structural Information

Molecular Formula
C22H18N2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC=CC=C3)N4C=CN=C4
InChI
InChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H
InChIKey
OCAPBUJLXMYKEJ-UHFFFAOYSA-N
Compound name
1-[phenyl-(4-phenylphenyl)methyl]imidazole
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

384
References

16821
Patents

310.147 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.15428 176.1
[M+Na]+ 333.13622 193.8
[M+NH4]+ 328.18082 185.6
[M+K]+ 349.11016 185.1
[M-H]- 309.13972 184.8
[M+Na-2H]- 331.12167 190.4
[M]+ 310.14645 181.4
[M]- 310.14755 181.4
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