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

895
Patents

174.94328 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.95056 122.7
[M+Na]+ 197.93250 136.0
[M-H]- 173.93600 127.1
[M+NH4]+ 192.97710 145.5
[M+K]+ 213.90644 125.6
[M+H-H2O]+ 157.94054 122.5
[M+HCOO]- 219.94148 143.9
[M+CH3COO]- 233.95713 176.8
[M+Na-2H]- 195.91795 133.0
[M]+ 174.94273 139.8
[M]- 174.94383 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