CID 101259

2-(4-fluorophenyl)-1h-benzimidazole

Structural Information

Molecular Formula
C13H9FN2
SMILES
C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)F
InChI
InChI=1S/C13H9FN2/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H,(H,15,16)
InChIKey
FPWUSPPQEHBWHC-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

57
Patents

212.07498 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.08226 144.2
[M+Na]+ 235.06420 160.0
[M+NH4]+ 230.10880 153.2
[M+K]+ 251.03814 153.3
[M-H]- 211.06770 147.1
[M+Na-2H]- 233.04965 153.8
[M]+ 212.07443 147.4
[M]- 212.07553 147.4
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