CID 21749565

1365271-95-9

Structural Information

Molecular Formula
C8H7FN2
SMILES
CN1C=NC2=C1C=CC(=C2)F
InChI
InChI=1S/C8H7FN2/c1-11-5-10-7-4-6(9)2-3-8(7)11/h2-5H,1H3
InChIKey
CJIVGQYHPZZEDW-UHFFFAOYSA-N
Compound name
5-fluoro-1-methylbenzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

259
Patents

150.05933 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.066606 125.0
[M+Na]+ 173.048548 137.4
[M-H]- 149.052054 126.8
[M+NH4]+ 168.093153 147.2
[M+K]+ 189.022488 134.2
[M+H-H2O]+ 133.056590 117.7
[M+HCOO]- 195.057531 148.5
[M+CH3COO]- 209.073181 140.2
[M+Na-2H]- 171.033996 133.4
[M]+ 150.05878142 126.4
[M]- 150.05987858 126.4
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

patents stripe