CID 2762779

3-bromo-4-fluoropyridine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

192
Patents

174.94328 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.95056 127.1
[M+Na]+ 197.93250 131.4
[M+NH4]+ 192.97710 132.4
[M+K]+ 213.90644 130.8
[M-H]- 173.93600 126.8
[M+Na-2H]- 195.91795 131.8
[M]+ 174.94273 126.4
[M]- 174.94383 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