CID 2760857

(trimethylsilyl)methyl trifluoromethanesulfonate [trimethylsilylmethylating reagent]

Structural Information

Molecular Formula

C₅H₁₁F₃O₃SSi

SMILES

C[Si](C)(C)COS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C5H11F3O3SSi/c1-13(2,3)4-11-12(9,10)5(6,7)8/h4H2,1-3H3

InChIKey

VMDMAAJZSXXCQV-UHFFFAOYSA-N

Compound name

trimethylsilylmethyl trifluoromethanesulfonate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 314
Patents: 236.01503 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	237.02231	142.1
[M+Na]+	259.00425	150.7
[M-H]-	235.00775	138.9
[M+NH4]+	254.04885	160.9
[M+K]+	274.97819	149.5
[M+H-H2O]+	219.01229	135.5
[M+HCOO]-	281.01323	153.8
[M+CH3COO]-	295.02888	184.3
[M+Na-2H]-	256.98970	146.6
[M]+	236.01448	142.9
[M]-	236.01558	142.9

Literature stripe

literature stripe

Patent stripe

patents stripe