CID 14569600

2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanamide

Structural Information

Molecular Formula
C4H2F7NO
SMILES
C(=O)(C(C(F)(F)F)(C(F)(F)F)F)N
InChI
InChI=1S/C4H2F7NO/c5-2(1(12)13,3(6,7)8)4(9,10)11/h(H2,12,13)
InChIKey
DEYAKVNIRRRJGO-UHFFFAOYSA-N
Compound name
2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

107
Patents

213.00246 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.009736 132.5
[M+Na]+ 235.991678 141.4
[M-H]- 211.995184 124.1
[M+NH4]+ 231.036283 150.2
[M+K]+ 251.965618 139.9
[M+H-H2O]+ 195.999720 123.2
[M+HCOO]- 258.000661 144.5
[M+CH3COO]- 272.016311 187.2
[M+Na-2H]- 233.977126 136.7
[M]+ 213.00191142 120.1
[M]- 213.00300858 120.1
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