CID 67596

1,4-dibromo-2,5-difluorobenzene

Structural Information

Molecular Formula
C6H2Br2F2
SMILES
C1=C(C(=CC(=C1Br)F)Br)F
InChI
InChI=1S/C6H2Br2F2/c7-3-1-5(9)4(8)2-6(3)10/h1-2H
InChIKey
GLVMLJCMUBZVTJ-UHFFFAOYSA-N
Compound name
1,4-dibromo-2,5-difluorobenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1057
Patents

269.84912 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.85640 148.5
[M+Na]+ 292.83834 144.2
[M+NH4]+ 287.88294 150.4
[M+K]+ 308.81228 149.4
[M-H]- 268.84184 148.1
[M+Na-2H]- 290.82379 149.7
[M]+ 269.84857 146.7
[M]- 269.84967 146.7
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

patents stripe