CID 2776734

2,2,3,3-tetrafluoro-propionamide

Structural Information

Molecular Formula
C3H3F4NO
SMILES
C(C(C(=O)N)(F)F)(F)F
InChI
InChI=1S/C3H3F4NO/c4-1(5)3(6,7)2(8)9/h1H,(H2,8,9)
InChIKey
WJNHHTXAWAPICM-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrafluoropropanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

49
Patents

145.01508 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.02236 120.7
[M+Na]+ 168.00430 128.7
[M-H]- 144.00780 115.8
[M+NH4]+ 163.04890 141.2
[M+K]+ 183.97824 128.3
[M+H-H2O]+ 128.01234 113.3
[M+HCOO]- 190.01328 138.5
[M+CH3COO]- 204.02893 176.4
[M+Na-2H]- 165.98975 124.3
[M]+ 145.01453 112.8
[M]- 145.01563 112.8
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