CID 9732

4-fluorophenol

Structural Information

Molecular Formula
C6H5FO
SMILES
C1=CC(=CC=C1O)F
InChI
InChI=1S/C6H5FO/c7-5-1-3-6(8)4-2-5/h1-4,8H
InChIKey
RHMPLDJJXGPMEX-UHFFFAOYSA-N
Compound name
4-fluorophenol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

68
References

21989
Patents

112.03244 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.03972 117.9
[M+Na]+ 135.02166 130.9
[M+NH4]+ 130.06626 126.9
[M+K]+ 150.99560 124.5
[M-H]- 111.02516 118.9
[M+Na-2H]- 133.00711 125.4
[M]+ 112.03189 119.9
[M]- 112.03299 119.9
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