CID 2733932

1,1'-difluoro-2,2'-bipyridinium bis(tetrafluoroborate)

Structural Information

Molecular Formula
C10H8F2N2
SMILES
C1=CC=[N+](C(=C1)C2=CC=CC=[N+]2F)F
InChI
InChI=1S/C10H8F2N2/c11-13-7-3-1-5-9(13)10-6-2-4-8-14(10)12/h1-8H/q+2
InChIKey
VWXNMFVNVKSKOB-UHFFFAOYSA-N
Compound name
1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

278
Patents

194.06555 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.072826 139.6
[M+Na]+ 217.054768 149.5
[M-H]- 193.058274 142.1
[M+NH4]+ 212.099373 155.6
[M+K]+ 233.028708 134.7
[M+H-H2O]+ 177.062810 135.1
[M+HCOO]- 239.063751 159.6
[M+CH3COO]- 253.079401 171.4
[M+Na-2H]- 215.040216 151.4
[M]+ 194.06500142 134.6
[M]- 194.06609858 134.6
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