CID 136268

1-chloro-2-iodotetrafluoroethane

Structural Information

Molecular Formula
C2ClF4I
SMILES
C(C(F)(F)I)(F)(F)Cl
InChI
InChI=1S/C2ClF4I/c3-1(4,5)2(6,7)8
InChIKey
XNIBSTIKPHNKSO-UHFFFAOYSA-N
Compound name
1-chloro-1,1,2,2-tetrafluoro-2-iodoethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

261.86694 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.87422 123.9
[M+Na]+ 284.85616 127.3
[M-H]- 260.85966 113.5
[M+NH4]+ 279.90076 140.9
[M+K]+ 300.83010 130.5
[M+H-H2O]+ 244.86420 114.9
[M+HCOO]- 306.86514 132.6
[M+CH3COO]- 320.88079 183.0
[M+Na-2H]- 282.84161 119.6
[M]+ 261.86639 117.5
[M]- 261.86749 117.5
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