CID 83920712

1399657-46-5

Structural Information

Molecular Formula

C₁₀H₉FO₃

SMILES

C1CC1(C(=O)O)OC2=CC=C(C=C2)F

InChI

InChI=1S/C10H9FO3/c11-7-1-3-8(4-2-7)14-10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)

InChIKey

JIFRXJWQLPSQGG-UHFFFAOYSA-N

Compound name

1-(4-fluorophenoxy)cyclopropane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 196.05357 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	197.060846	136.6
[M+Na]+	219.042788	146.5
[M-H]-	195.046294	142.1
[M+NH4]+	214.087393	152.3
[M+K]+	235.016728	144.4
[M+H-H2O]+	179.050830	130.5
[M+HCOO]-	241.051771	158.3
[M+CH3COO]-	255.067421	183.0
[M+Na-2H]-	217.028236	143.0
[M]+	196.05302142	138.9
[M]-	196.05411858	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe