CID 545813

[ditert-butyl(trifluoromethylsulfonyloxy)silyl] trifluoromethanesulfonate

Structural Information

Molecular Formula
C10H18F6O6S2Si
SMILES
CC(C)(C)[Si](C(C)(C)C)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C10H18F6O6S2Si/c1-7(2,3)25(8(4,5)6,21-23(17,18)9(11,12)13)22-24(19,20)10(14,15)16/h1-6H3
InChIKey
HUHKPYLEVGCJTG-UHFFFAOYSA-N
Compound name
[ditert-butyl(trifluoromethylsulfonyloxy)silyl] trifluoromethanesulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

383
Patents

440.02182 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.02910 182.2
[M+Na]+ 463.01104 175.9
[M-H]- 439.01454 176.5
[M+NH4]+ 458.05564 183.1
[M+K]+ 478.98498 186.1
[M+H-H2O]+ 423.01908 172.6
[M+HCOO]- 485.02002 196.2
[M+CH3COO]- 499.03567 216.2
[M+Na-2H]- 460.99649 189.1
[M]+ 440.02127 182.8
[M]- 440.02237 182.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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