CID 23500129

2-fluoropropanoyl fluoride

Structural Information

Molecular Formula
C3H4F2O
SMILES
CC(C(=O)F)F
InChI
InChI=1S/C3H4F2O/c1-2(4)3(5)6/h2H,1H3
InChIKey
INGFLBLMEBWCNV-UHFFFAOYSA-N
Compound name
2-fluoropropanoyl fluoride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

45
Patents

94.02302 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 95.030296 111.3
[M+Na]+ 117.012238 119.6
[M-H]- 93.015744 109.5
[M+NH4]+ 112.056843 134.7
[M+K]+ 132.986178 120.3
[M+H-H2O]+ 77.020280 105.8
[M+HCOO]- 139.021221 132.4
[M+CH3COO]- 153.036871 166.4
[M+Na-2H]- 114.997686 116.5
[M]+ 94.02247142 108.4
[M]- 94.02356858 108.4
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

patents stripe