CID 507383

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

Structural Information

Molecular Formula
C19H15FN2O2
SMILES
COC1=CC=CC2=C1N=C(N2CC3=CC=CO3)C4=CC=CC=C4F
InChI
InChI=1S/C19H15FN2O2/c1-23-17-10-4-9-16-18(17)21-19(14-7-2-3-8-15(14)20)22(16)12-13-6-5-11-24-13/h2-11H,12H2,1H3
InChIKey
LBQHWVAQXMWXFC-UHFFFAOYSA-N
Compound name
2-(2-fluorophenyl)-1-(furan-2-ylmethyl)-4-methoxybenzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.11176 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.11904 172.3
[M+Na]+ 345.10098 184.0
[M-H]- 321.10448 181.4
[M+NH4]+ 340.14558 187.3
[M+K]+ 361.07492 179.3
[M+H-H2O]+ 305.10902 162.8
[M+HCOO]- 367.10996 194.9
[M+CH3COO]- 381.12561 185.1
[M+Na-2H]- 343.08643 174.9
[M]+ 322.11121 177.4
[M]- 322.11231 177.4
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.