CID 12829600

73606-15-2

Structural Information

Molecular Formula
C10ClF21O3S
SMILES
C(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(C(C(C(OC(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10ClF21O3S/c11-7(24,25)5(20,21)3(16,17)1(12,13)2(14,15)4(18,19)6(22,23)8(26,27)35-9(28,29)10(30,31)36(32,33)34
InChIKey
UQBUBNOZWZCKIV-UHFFFAOYSA-N
Compound name
2-(8-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctoxy)-1,1,2,2-tetrafluoroethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

633.89215 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 634.89943 180.0
[M+Na]+ 656.88137 183.2
[M-H]- 632.88487 189.8
[M+NH4]+ 651.92597 192.5
[M+K]+ 672.85531 195.5
[M+H-H2O]+ 616.88941 167.7
[M+HCOO]- 678.89035 200.5
[M+CH3COO]- 692.90600 250.1
[M+Na-2H]- 654.86682 180.6
[M]+ 633.89160 183.9
[M]- 633.89270 183.9
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

No patent data available for this compound.