CID 81358819

2-cyclopentyl-2-fluoroacetic acid

Structural Information

Molecular Formula
C7H11FO2
SMILES
C1CCC(C1)C(C(=O)O)F
InChI
InChI=1S/C7H11FO2/c8-6(7(9)10)5-3-1-2-4-5/h5-6H,1-4H2,(H,9,10)
InChIKey
YAVQIHQJYSZZQJ-UHFFFAOYSA-N
Compound name
2-cyclopentyl-2-fluoroacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.07431 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.08159 132.4
[M+Na]+ 169.06353 139.8
[M+NH4]+ 164.10813 139.6
[M+K]+ 185.03747 137.5
[M-H]- 145.06703 130.7
[M+Na-2H]- 167.04898 134.6
[M]+ 146.07376 132.5
[M]- 146.07486 132.5
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.