CID 15369694

2-bromo-3-fluoropyrazine

Structural Information

Molecular Formula
C4H2BrFN2
SMILES
C1=CN=C(C(=N1)F)Br
InChI
InChI=1S/C4H2BrFN2/c5-3-4(6)8-2-1-7-3/h1-2H
InChIKey
QIDLQERJCKEQOL-UHFFFAOYSA-N
Compound name
2-bromo-3-fluoropyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

175.93854 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.94582 127.2
[M+Na]+ 198.92776 131.5
[M+NH4]+ 193.97236 131.9
[M+K]+ 214.90170 131.2
[M-H]- 174.93126 126.2
[M+Na-2H]- 196.91321 131.8
[M]+ 175.93799 126.3
[M]- 175.93909 126.3
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