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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.08159 131.4
[M+Na]+ 181.06353 139.1
[M-H]- 157.06703 133.7
[M+NH4]+ 176.10813 154.1
[M+K]+ 197.03747 138.3
[M+H-H2O]+ 141.07157 125.5
[M+HCOO]- 203.07251 154.1
[M+CH3COO]- 217.08816 175.9
[M+Na-2H]- 179.04898 134.4
[M]+ 158.07376 130.8
[M]- 158.07486 130.8
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.