CID 2775169

1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethanesulfonyl fluoride

Structural Information

Molecular Formula
C4F9IO3S
SMILES
C(C(F)(F)S(=O)(=O)F)(OC(C(F)(F)I)(F)F)(F)F
InChI
InChI=1S/C4F9IO3S/c5-1(6,14)2(7,8)17-3(9,10)4(11,12)18(13,15)16
InChIKey
XSLYISNQTJHKMP-UHFFFAOYSA-N
Compound name
1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

207
Patents

425.84692 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.85420 159.5
[M+Na]+ 448.83614 162.2
[M-H]- 424.83964 143.7
[M+NH4]+ 443.88074 168.9
[M+K]+ 464.81008 165.5
[M+H-H2O]+ 408.84418 145.4
[M+HCOO]- 470.84512 158.6
[M+CH3COO]- 484.86077 207.7
[M+Na-2H]- 446.82159 152.5
[M]+ 425.84637 148.2
[M]- 425.84747 148.2
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