CID 67885

Bistrifluoroacetamide

Structural Information

Molecular Formula
C4HF6NO2
SMILES
C(=O)(C(F)(F)F)NC(=O)C(F)(F)F
InChI
InChI=1S/C4HF6NO2/c5-3(6,7)1(12)11-2(13)4(8,9)10/h(H,11,12,13)
InChIKey
GMQVFHZSXKJCIV-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

598
Patents

208.99115 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.99843 157.4
[M+Na]+ 231.98037 159.8
[M+NH4]+ 227.02497 158.4
[M+K]+ 247.95431 157.8
[M-H]- 207.98387 148.4
[M+Na-2H]- 229.96582 155.5
[M]+ 208.99060 154.5
[M]- 208.99170 154.5
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