CID 129977467

Ethyl 2-fluoro-2-(oxetan-3-ylidene)acetate

Structural Information

Molecular Formula
C7H9FO3
SMILES
CCOC(=O)C(=C1COC1)F
InChI
InChI=1S/C7H9FO3/c1-2-11-7(9)6(8)5-3-10-4-5/h2-4H2,1H3
InChIKey
ZLENGPIYFNYJAJ-UHFFFAOYSA-N
Compound name
ethyl 2-fluoro-2-(oxetan-3-ylidene)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.05357 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.06085 129.0
[M+Na]+ 183.04279 134.1
[M-H]- 159.04629 131.7
[M+NH4]+ 178.08739 141.8
[M+K]+ 199.01673 138.3
[M+H-H2O]+ 143.05083 118.0
[M+HCOO]- 205.05177 148.0
[M+CH3COO]- 219.06742 178.9
[M+Na-2H]- 181.02824 133.3
[M]+ 160.05302 137.2
[M]- 160.05412 137.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.