CID 2776755

2,2,3,3-tetrafluoropropyl trifluoroacetate

Structural Information

Molecular Formula
C5H3F7O2
SMILES
C(C(C(F)F)(F)F)OC(=O)C(F)(F)F
InChI
InChI=1S/C5H3F7O2/c6-2(7)4(8,9)1-14-3(13)5(10,11)12/h2H,1H2
InChIKey
QWXXHRSQCJGYQR-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrafluoropropyl 2,2,2-trifluoroacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

203
Patents

228.00212 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.00940 136.0
[M+Na]+ 250.99134 144.8
[M-H]- 226.99484 127.8
[M+NH4]+ 246.03594 153.6
[M+K]+ 266.96528 143.9
[M+H-H2O]+ 210.99938 126.3
[M+HCOO]- 273.00032 148.3
[M+CH3COO]- 287.01597 188.4
[M+Na-2H]- 248.97679 138.6
[M]+ 228.00157 127.4
[M]- 228.00267 127.4
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