CID 16843

Trifluoromethyl iodide

Structural Information

Molecular Formula
CF3I
SMILES
C(F)(F)(F)I
InChI
InChI=1S/CF3I/c2-1(3,4)5
InChIKey
VPAYJEUHKVESSD-UHFFFAOYSA-N
Compound name
trifluoro(iodo)methane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

28
References

9680
Patents

195.89967 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.90695 114.3
[M+Na]+ 218.88889 116.8
[M-H]- 194.89239 105.1
[M+NH4]+ 213.93349 133.0
[M+K]+ 234.86283 122.6
[M+H-H2O]+ 178.89693 105.2
[M+HCOO]- 240.89787 130.0
[M+CH3COO]- 254.91352 173.3
[M+Na-2H]- 216.87434 110.5
[M]+ 195.89912 107.5
[M]- 195.90022 107.5
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