CID 82068

4-fluorophenethyl alcohol

Structural Information

Molecular Formula
C8H9FO
SMILES
C1=CC(=CC=C1CCO)F
InChI
InChI=1S/C8H9FO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2
InChIKey
MWUVGXCUHWKQJE-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

1556
Patents

140.06374 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.07102 127.0
[M+Na]+ 163.05296 139.6
[M+NH4]+ 158.09756 135.7
[M+K]+ 179.02690 132.8
[M-H]- 139.05646 128.0
[M+Na-2H]- 161.03841 134.0
[M]+ 140.06319 129.0
[M]- 140.06429 129.0
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