CID 121235706

1449472-57-4

Structural Information

Molecular Formula
C10H11Br2F3O3SSi
SMILES
C[Si](C)(C)C1=C(C(=CC(=C1)Br)Br)OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C10H11Br2F3O3SSi/c1-20(2,3)8-5-6(11)4-7(12)9(8)18-19(16,17)10(13,14)15/h4-5H,1-3H3
InChIKey
MTIUFXYVKSIUCH-UHFFFAOYSA-N
Compound name
(2,4-dibromo-6-trimethylsilylphenyl) trifluoromethanesulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

453.8517 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 454.85898 165.9
[M+Na]+ 476.84092 178.2
[M-H]- 452.84442 170.1
[M+NH4]+ 471.88552 181.4
[M+K]+ 492.81486 161.4
[M+H-H2O]+ 436.84896 171.8
[M+HCOO]- 498.84990 172.5
[M+CH3COO]- 512.86555 220.0
[M+Na-2H]- 474.82637 170.3
[M]+ 453.85115 200.2
[M]- 453.85225 200.2
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.