CID 345420

4-fluoro-4'-hydroxybiphenyl

Structural Information

Molecular Formula
C12H9FO
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)F)O
InChI
InChI=1S/C12H9FO/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,14H
InChIKey
QSJNKJGPJVOGPK-UHFFFAOYSA-N
Compound name
4-(4-fluorophenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

470
Patents

188.06374 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.071016 136.3
[M+Na]+ 211.052958 145.4
[M-H]- 187.056464 141.1
[M+NH4]+ 206.097563 155.5
[M+K]+ 227.026898 141.2
[M+H-H2O]+ 171.061000 129.2
[M+HCOO]- 233.061941 159.2
[M+CH3COO]- 247.077591 180.4
[M+Na-2H]- 209.038406 143.2
[M]+ 188.06319142 134.0
[M]- 188.06428858 134.0
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