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

73
Patents

118.04301 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.05029 119.7
[M+Na]+ 141.03223 127.8
[M-H]- 117.03573 119.0
[M+NH4]+ 136.07683 142.3
[M+K]+ 157.00617 127.7
[M+H-H2O]+ 101.04027 114.7
[M+HCOO]- 163.04121 142.7
[M+CH3COO]- 177.05686 169.1
[M+Na-2H]- 139.01768 125.7
[M]+ 118.04246 120.2
[M]- 118.04356 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