CID 5237

Fluoroacetic acid

Structural Information

Molecular Formula
C2H3FO2
SMILES
C(C(=O)O)F
InChI
InChI=1S/C2H3FO2/c3-1-2(4)5/h1H2,(H,4,5)
InChIKey
QEWYKACRFQMRMB-UHFFFAOYSA-N
Compound name
2-fluoroacetic acid
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

392
References

75871
Patents

78.01171 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 79.018986 108.0
[M+Na]+ 101.00093 116.5
[M-H]- 77.004434 106.2
[M+NH4]+ 96.045533 131.4
[M+K]+ 116.97487 116.8
[M+H-H2O]+ 61.008970 103.6
[M+HCOO]- 123.00991 130.2
[M+CH3COO]- 137.02556 158.9
[M+Na-2H]- 98.986376 114.9
[M]+ 78.011161 106.2
[M]- 78.012259 106.2
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

No patent data available for this compound.