CID 59286319

6-bromo-7-fluoroquinoxaline

Structural Information

Molecular Formula
C8H4BrFN2
SMILES
C1=CN=C2C=C(C(=CC2=N1)F)Br
InChI
InChI=1S/C8H4BrFN2/c9-5-3-7-8(4-6(5)10)12-2-1-11-7/h1-4H
InChIKey
ZLMXEQNQJFSIMI-UHFFFAOYSA-N
Compound name
6-bromo-7-fluoroquinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

225.9542 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.96148 135.8
[M+Na]+ 248.94342 149.9
[M-H]- 224.94692 139.8
[M+NH4]+ 243.98802 156.5
[M+K]+ 264.91736 138.3
[M+H-H2O]+ 208.95146 134.7
[M+HCOO]- 270.95240 154.7
[M+CH3COO]- 284.96805 151.2
[M+Na-2H]- 246.92887 146.7
[M]+ 225.95365 153.7
[M]- 225.95475 153.7
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