CID 507381

2-(2-fluorophenyl)-4-methoxy-1-(2-naphthylmethyl)benzimidazole

Structural Information

Molecular Formula
C25H19FN2O
SMILES
COC1=CC=CC2=C1N=C(N2CC3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5F
InChI
InChI=1S/C25H19FN2O/c1-29-23-12-6-11-22-24(23)27-25(20-9-4-5-10-21(20)26)28(22)16-17-13-14-18-7-2-3-8-19(18)15-17/h2-15H,16H2,1H3
InChIKey
HXZNNHMWHACFNR-UHFFFAOYSA-N
Compound name
2-(2-fluorophenyl)-4-methoxy-1-(naphthalen-2-ylmethyl)benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.14813 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.15541 194.4
[M+Na]+ 405.13735 205.3
[M-H]- 381.14085 202.7
[M+NH4]+ 400.18195 206.9
[M+K]+ 421.11129 196.5
[M+H-H2O]+ 365.14539 182.0
[M+HCOO]- 427.14633 213.8
[M+CH3COO]- 441.16198 204.6
[M+Na-2H]- 403.12280 197.8
[M]+ 382.14758 197.1
[M]- 382.14868 197.1
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.