CID 65017562

2089258-23-9

Structural Information

Molecular Formula
C15H13FN2O
SMILES
COC1=CC2=C(C=C1)N=C(N2)CC3=CC=C(C=C3)F
InChI
InChI=1S/C15H13FN2O/c1-19-12-6-7-13-14(9-12)18-15(17-13)8-10-2-4-11(16)5-3-10/h2-7,9H,8H2,1H3,(H,17,18)
InChIKey
LZGPKCZFMYXOON-UHFFFAOYSA-N
Compound name
2-[(4-fluorophenyl)methyl]-6-methoxy-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.1012 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.10848 155.6
[M+Na]+ 279.09042 166.6
[M-H]- 255.09392 158.9
[M+NH4]+ 274.13502 172.4
[M+K]+ 295.06436 160.4
[M+H-H2O]+ 239.09846 146.5
[M+HCOO]- 301.09940 176.7
[M+CH3COO]- 315.11505 168.0
[M+Na-2H]- 277.07587 161.2
[M]+ 256.10065 156.8
[M]- 256.10175 156.8
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.