CID 14800484

18645-89-1

Structural Information

Molecular Formula
C8H7FN2
SMILES
CC1=NC2=C(N1)C=CC=C2F
InChI
InChI=1S/C8H7FN2/c1-5-10-7-4-2-3-6(9)8(7)11-5/h2-4H,1H3,(H,10,11)
InChIKey
DPTKIOOAVCOXBE-UHFFFAOYSA-N
Compound name
4-fluoro-2-methyl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

150.05933 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.066606 125.7
[M+Na]+ 173.048548 137.7
[M-H]- 149.052054 126.0
[M+NH4]+ 168.093153 147.1
[M+K]+ 189.022488 133.5
[M+H-H2O]+ 133.056590 118.7
[M+HCOO]- 195.057531 147.6
[M+CH3COO]- 209.073181 140.1
[M+Na-2H]- 171.033996 133.6
[M]+ 150.05878142 125.2
[M]- 150.05987858 125.2
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

patents stripe