CID 69535

646-63-9

Structural Information

Molecular Formula
C2ClF9S
SMILES
C(C(F)(F)Cl)(F)(F)S(F)(F)(F)(F)F
InChI
InChI=1S/C2ClF9S/c3-1(4,5)2(6,7)13(8,9,10,11)12
InChIKey
KUEFXXIVCUKGLZ-UHFFFAOYSA-N
Compound name
(2-chloro-1,1,2,2-tetrafluoroethyl)-pentafluoro-lambda6-sulfane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.92654 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.93382 174.1
[M+Na]+ 284.91576 175.6
[M+NH4]+ 279.96036 174.5
[M+K]+ 300.88970 172.0
[M-H]- 260.91926 166.7
[M+Na-2H]- 282.90121 171.7
[M]+ 261.92599 172.1
[M]- 261.92709 172.1
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

No patent data available for this compound.