CID 99938556

1449472-59-6

Structural Information

Molecular Formula
C10H12ClF3O3SSi
SMILES
C[Si](C)(C)C1=C(C(=CC=C1)Cl)OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C10H12ClF3O3SSi/c1-19(2,3)8-6-4-5-7(11)9(8)17-18(15,16)10(12,13)14/h4-6H,1-3H3
InChIKey
QFWUIGWOSVHZMC-UHFFFAOYSA-N
Compound name
(2-chloro-6-trimethylsilylphenyl) trifluoromethanesulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

331.9917 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.99898 161.7
[M+Na]+ 354.98092 172.0
[M-H]- 330.98442 162.3
[M+NH4]+ 350.02552 177.9
[M+K]+ 370.95486 167.4
[M+H-H2O]+ 314.98896 154.8
[M+HCOO]- 376.98990 169.0
[M+CH3COO]- 391.00555 200.6
[M+Na-2H]- 352.96637 165.1
[M]+ 331.99115 164.8
[M]- 331.99225 164.8
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