CID 24689405

2-bromo-4-fluoro-n,n-dimethylbenzamide

Structural Information

Molecular Formula
C9H9BrFNO
SMILES
CN(C)C(=O)C1=C(C=C(C=C1)F)Br
InChI
InChI=1S/C9H9BrFNO/c1-12(2)9(13)7-4-3-6(11)5-8(7)10/h3-5H,1-2H3
InChIKey
CGUIJOTZYHWBSQ-UHFFFAOYSA-N
Compound name
2-bromo-4-fluoro-N,N-dimethylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.98515 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.99243 143.7
[M+Na]+ 267.97437 146.3
[M+NH4]+ 263.01897 148.1
[M+K]+ 283.94831 146.7
[M-H]- 243.97787 143.7
[M+Na-2H]- 265.95982 146.9
[M]+ 244.98460 142.8
[M]- 244.98570 142.8
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

No patent data available for this compound.