CID 2778025

Trimethylsilyl nonafluorobutanesulfonate

Structural Information

Molecular Formula
C7H9F9O3SSi
SMILES
C[Si](C)(C)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7H9F9O3SSi/c1-21(2,3)19-20(17,18)7(15,16)5(10,11)4(8,9)6(12,13)14/h1-3H3
InChIKey
XMIPIKYUVSCYKT-UHFFFAOYSA-N
Compound name
trimethylsilyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

171
Patents

371.9898 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.99708 164.6
[M+Na]+ 394.97902 172.9
[M-H]- 370.98252 154.3
[M+NH4]+ 390.02362 176.9
[M+K]+ 410.95296 170.8
[M+H-H2O]+ 354.98706 153.5
[M+HCOO]- 416.98800 165.0
[M+CH3COO]- 431.00365 209.5
[M+Na-2H]- 392.96447 168.9
[M]+ 371.98925 155.5
[M]- 371.99035 155.5
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

patents stripe