CID 28911485

4-(2-bromophenyl)phenol

Structural Information

Molecular Formula
C12H9BrO
SMILES
C1=CC=C(C(=C1)C2=CC=C(C=C2)O)Br
InChI
InChI=1S/C12H9BrO/c13-12-4-2-1-3-11(12)9-5-7-10(14)8-6-9/h1-8,14H
InChIKey
XESUCEJPGYWGSK-UHFFFAOYSA-N
Compound name
4-(2-bromophenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

247.98367 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.99095 143.9
[M+Na]+ 270.97289 150.0
[M+NH4]+ 266.01749 150.0
[M+K]+ 286.94683 148.3
[M-H]- 246.97639 147.2
[M+Na-2H]- 268.95834 150.9
[M]+ 247.98312 144.7
[M]- 247.98422 144.7
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