CID 80693972

1-(2-fluoroethyl)cyclobutane-1-carboxylic acid

Structural Information

Molecular Formula
C7H11FO2
SMILES
C1CC(C1)(CCF)C(=O)O
InChI
InChI=1S/C7H11FO2/c8-5-4-7(6(9)10)2-1-3-7/h1-5H2,(H,9,10)
InChIKey
DTIKMWLDJUHXGQ-UHFFFAOYSA-N
Compound name
1-(2-fluoroethyl)cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.07431 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.08159 134.2
[M+Na]+ 169.06353 138.6
[M+NH4]+ 164.10813 138.7
[M+K]+ 185.03747 134.0
[M-H]- 145.06703 130.1
[M+Na-2H]- 167.04898 136.2
[M]+ 146.07376 132.3
[M]- 146.07486 132.3
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.