CID 67722

Pentafluoropropionamide

Structural Information

Molecular Formula
C3H2F5NO
SMILES
C(=O)(C(C(F)(F)F)(F)F)N
InChI
InChI=1S/C3H2F5NO/c4-2(5,1(9)10)3(6,7)8/h(H2,9,10)
InChIKey
KQTOYEUYHXUEDB-UHFFFAOYSA-N
Compound name
2,2,3,3,3-pentafluoropropanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

336
Patents

163.00566 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.01294 143.3
[M+Na]+ 185.99488 147.1
[M+NH4]+ 181.03948 145.9
[M+K]+ 201.96882 144.9
[M-H]- 161.99838 135.4
[M+Na-2H]- 183.98033 142.8
[M]+ 163.00511 141.0
[M]- 163.00621 141.0
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