CID 13514641

Ethyl 2-fluoro-3-hydroxy-2-methylpropanoate

Structural Information

Molecular Formula
C6H11FO3
SMILES
CCOC(=O)C(C)(CO)F
InChI
InChI=1S/C6H11FO3/c1-3-10-5(9)6(2,7)4-8/h8H,3-4H2,1-2H3
InChIKey
DLWIEHPLFDUIGE-UHFFFAOYSA-N
Compound name
ethyl 2-fluoro-3-hydroxy-2-methylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

150.06923 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.07651 129.4
[M+Na]+ 173.05845 136.8
[M-H]- 149.06195 127.3
[M+NH4]+ 168.10305 150.1
[M+K]+ 189.03239 136.9
[M+H-H2O]+ 133.06649 124.7
[M+HCOO]- 195.06743 149.1
[M+CH3COO]- 209.08308 172.7
[M+Na-2H]- 171.04390 134.9
[M]+ 150.06868 130.0
[M]- 150.06978 130.0
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