CID 146155455

2416231-35-9

Structural Information

Molecular Formula
C8H11F5O4S
SMILES
C1COCCC1C(COS(=O)(=O)C(F)(F)F)(F)F
InChI
InChI=1S/C8H11F5O4S/c9-7(10,6-1-3-16-4-2-6)5-17-18(14,15)8(11,12)13/h6H,1-5H2
InChIKey
YOGDMDNHGZQHOG-UHFFFAOYSA-N
Compound name
[2,2-difluoro-2-(oxan-4-yl)ethyl] trifluoromethanesulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.02982 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.03710 154.7
[M+Na]+ 321.01904 161.0
[M-H]- 297.02254 151.7
[M+NH4]+ 316.06364 168.4
[M+K]+ 336.99298 160.1
[M+H-H2O]+ 281.02708 145.4
[M+HCOO]- 343.02802 160.8
[M+CH3COO]- 357.04367 194.4
[M+Na-2H]- 319.00449 158.8
[M]+ 298.02927 149.3
[M]- 298.03037 149.3
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.