CID 155822556

2503209-40-1

Structural Information

Molecular Formula
C6H5BrFNO
SMILES
CC1=C(C=C(C(=O)N1)F)Br
InChI
InChI=1S/C6H5BrFNO/c1-3-4(7)2-5(8)6(10)9-3/h2H,1H3,(H,9,10)
InChIKey
UVCOYAJLJSYTEX-UHFFFAOYSA-N
Compound name
5-bromo-3-fluoro-6-methyl-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.95386 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.96114 134.8
[M+Na]+ 227.94308 138.6
[M+NH4]+ 222.98768 138.8
[M+K]+ 243.91702 138.7
[M-H]- 203.94658 133.4
[M+Na-2H]- 225.92853 137.7
[M]+ 204.95331 133.6
[M]- 204.95441 133.6
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

No patent data available for this compound.