CID 637733

2-(4-fluorophenyl)-2-propanol

Structural Information

Molecular Formula
C9H11FO
SMILES
CC(C)(C1=CC=C(C=C1)F)O
InChI
InChI=1S/C9H11FO/c1-9(2,11)7-3-5-8(10)6-4-7/h3-6,11H,1-2H3
InChIKey
QURXIISLVHJNGB-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

154.07939 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.08667 132.2
[M+Na]+ 177.06861 144.2
[M+NH4]+ 172.11321 140.5
[M+K]+ 193.04255 138.4
[M-H]- 153.07211 132.5
[M+Na-2H]- 175.05406 138.8
[M]+ 154.07884 134.0
[M]- 154.07994 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

No literature data available for this compound.

Patent stripe

patents stripe