CID 2783344

453-32-7

Structural Information

Molecular Formula
C4H7F3N2O
SMILES
C(C(C(F)(F)F)N)C(=O)N
InChI
InChI=1S/C4H7F3N2O/c5-4(6,7)2(8)1-3(9)10/h2H,1,8H2,(H2,9,10)
InChIKey
FUSSGZXYMBXVGS-UHFFFAOYSA-N
Compound name
3-amino-4,4,4-trifluorobutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

156.05104 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.05832 131.2
[M+Na]+ 179.04026 135.6
[M+NH4]+ 174.08486 135.4
[M+K]+ 195.01420 133.8
[M-H]- 155.04376 125.6
[M+Na-2H]- 177.02571 131.5
[M]+ 156.05049 129.5
[M]- 156.05159 129.5
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