CID 12498021

Potassium 2,2-difluoro-3-methoxy-3-oxopropanoate

Structural Information

Molecular Formula
C4H4F2O4
SMILES
COC(=O)C(C(=O)O)(F)F
InChI
InChI=1S/C4H4F2O4/c1-10-3(9)4(5,6)2(7)8/h1H3,(H,7,8)
InChIKey
FIYDDOBDGUYWSX-UHFFFAOYSA-N
Compound name
2,2-difluoro-3-methoxy-3-oxopropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

154.00777 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.01505 123.1
[M+Na]+ 176.99699 131.4
[M-H]- 153.00049 120.0
[M+NH4]+ 172.04159 143.3
[M+K]+ 192.97093 131.9
[M+H-H2O]+ 137.00503 117.7
[M+HCOO]- 199.00597 141.8
[M+CH3COO]- 213.02162 171.4
[M+Na-2H]- 174.98244 128.0
[M]+ 154.00722 121.8
[M]- 154.00832 121.8
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

patents stripe