CID 9842

406-23-5

Structural Information

Molecular Formula
C5H7FO2
SMILES
C=CCOC(=O)CF
InChI
InChI=1S/C5H7FO2/c1-2-3-8-5(7)4-6/h2H,1,3-4H2
InChIKey
KPJCWOXNYPYSPJ-UHFFFAOYSA-N
Compound name
prop-2-enyl 2-fluoroacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

118.04301 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.050286 119.7
[M+Na]+ 141.032228 127.8
[M-H]- 117.035734 119.0
[M+NH4]+ 136.076833 142.3
[M+K]+ 157.006168 127.7
[M+H-H2O]+ 101.040270 114.7
[M+HCOO]- 163.041211 142.7
[M+CH3COO]- 177.056861 169.1
[M+Na-2H]- 139.017676 125.7
[M]+ 118.04246142 120.2
[M]- 118.04355858 120.2
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

patents stripe