CID 820206

3-bromo-5-fluoropyridine

Structural Information

Molecular Formula
C5H3BrFN
SMILES
C1=C(C=NC=C1Br)F
InChI
InChI=1S/C5H3BrFN/c6-4-1-5(7)3-8-2-4/h1-3H
InChIKey
HNNNBQRRIHKFLI-UHFFFAOYSA-N
Compound name
3-bromo-5-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1716
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

literature stripe

Patent stripe

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