CID 60878402

2-(3-fluorophenoxy)cyclopentan-1-ol

Structural Information

Molecular Formula
C11H13FO2
SMILES
C1CC(C(C1)OC2=CC(=CC=C2)F)O
InChI
InChI=1S/C11H13FO2/c12-8-3-1-4-9(7-8)14-11-6-2-5-10(11)13/h1,3-4,7,10-11,13H,2,5-6H2
InChIKey
NMRAJBFDUFYELZ-UHFFFAOYSA-N
Compound name
2-(3-fluorophenoxy)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.08995 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.09723 140.1
[M+Na]+ 219.07917 147.3
[M-H]- 195.08267 144.2
[M+NH4]+ 214.12377 160.6
[M+K]+ 235.05311 144.5
[M+H-H2O]+ 179.08721 133.4
[M+HCOO]- 241.08815 161.3
[M+CH3COO]- 255.10380 180.0
[M+Na-2H]- 217.06462 142.9
[M]+ 196.08940 136.8
[M]- 196.09050 136.8
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

No patent data available for this compound.