CID 118798294

3-bromo-4-fluoro-2-methoxypyridine

Structural Information

Molecular Formula
C6H5BrFNO
SMILES
COC1=NC=CC(=C1Br)F
InChI
InChI=1S/C6H5BrFNO/c1-10-6-5(7)4(8)2-3-9-6/h2-3H,1H3
InChIKey
RRWUVLPVWOLDSD-UHFFFAOYSA-N
Compound name
3-bromo-4-fluoro-2-methoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

204.95386 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.96114 134.8
[M+Na]+ 227.94308 138.9
[M+NH4]+ 222.98768 139.5
[M+K]+ 243.91702 138.6
[M-H]- 203.94658 134.1
[M+Na-2H]- 225.92853 138.6
[M]+ 204.95331 134.0
[M]- 204.95441 134.0
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