CID 21885884

2-bromo-4-fluoropyridine

Structural Information

Molecular Formula
C5H3BrFN
SMILES
C1=CN=C(C=C1F)Br
InChI
InChI=1S/C5H3BrFN/c6-5-3-4(7)1-2-8-5/h1-3H
InChIKey
AIEATTRZKVGMBO-UHFFFAOYSA-N
Compound name
2-bromo-4-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

881
Patents

174.94328 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.950556 122.7
[M+Na]+ 197.932498 136.0
[M-H]- 173.936004 127.1
[M+NH4]+ 192.977103 145.5
[M+K]+ 213.906438 125.6
[M+H-H2O]+ 157.940540 122.5
[M+HCOO]- 219.941481 143.9
[M+CH3COO]- 233.957131 176.8
[M+Na-2H]- 195.917946 133.0
[M]+ 174.94273142 139.8
[M]- 174.94382858 139.8
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