CID 2724577

1-fluoropyridinium tetrafluoroborate [fluorinating reagent]

Structural Information

Molecular Formula
C5H5FN
SMILES
C1=CC=[N+](C=C1)F
InChI
InChI=1S/C5H5FN/c6-7-4-2-1-3-5-7/h1-5H/q+1
InChIKey
UWDCUCCPBLHLTI-UHFFFAOYSA-N
Compound name
1-fluoropyridin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1732
Patents

98.0406 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.047876 112.6
[M+Na]+ 121.02982 121.8
[M-H]- 97.033324 114.3
[M+NH4]+ 116.07442 134.4
[M+K]+ 137.00376 115.3
[M+H-H2O]+ 81.037860 108.9
[M+HCOO]- 143.03880 135.9
[M+CH3COO]- 157.05445 158.3
[M+Na-2H]- 119.01527 124.8
[M]+ 98.040051 109.3
[M]- 98.041149 109.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe