CID 34177

2,5-dibromophenol

Structural Information

Molecular Formula
C6H4Br2O
SMILES
C1=CC(=C(C=C1Br)O)Br
InChI
InChI=1S/C6H4Br2O/c7-4-1-2-5(8)6(9)3-4/h1-3,9H
InChIKey
GUXWVUVLXIJHQF-UHFFFAOYSA-N
Compound name
2,5-dibromophenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

426
Patents

249.86288 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.87016 138.6
[M+Na]+ 272.85210 134.4
[M+NH4]+ 267.89670 141.1
[M+K]+ 288.82604 140.7
[M-H]- 248.85560 139.5
[M+Na-2H]- 270.83755 140.9
[M]+ 249.86233 137.2
[M]- 249.86343 137.2
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