CID 45090315

173277-81-1

Structural Information

Molecular Formula

C₈H₁₁FO₂

SMILES

CCOC(=O)C1=C(CCC1)F

InChI

InChI=1S/C8H11FO2/c1-2-11-8(10)6-4-3-5-7(6)9/h2-5H2,1H3

InChIKey

YIANBNJBFSHEFE-UHFFFAOYSA-N

Compound name

ethyl 2-fluorocyclopentene-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 158.07431 Da
Monoisotopic Mass: 1.5
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]+	159.08159	134.4
[M+Na]+	181.06353	143.7
[M+NH4]+	176.10813	142.0
[M+K]+	197.03747	140.2
[M-H]-	157.06703	133.6
[M+Na-2H]-	179.04898	138.0
[M]+	158.07376	135.1
[M]-	158.07486	135.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.