CID 3290840

Phenyl trimethylsilylmethyl sulfone

Structural Information

Molecular Formula

C₁₀H₁₆O₂SSi

SMILES

C[Si](C)(C)CS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C10H16O2SSi/c1-14(2,3)9-13(11,12)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3

InChIKey

OEXJFEDAGJGOEP-UHFFFAOYSA-N

Compound name

benzenesulfonylmethyl(trimethyl)silane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 228.06403 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]+	229.07131	150.5
[M+Na]+	251.05325	161.8
[M+NH4]+	246.09785	158.5
[M+K]+	267.02719	154.4
[M-H]-	227.05675	151.2
[M+Na-2H]-	249.03870	156.3
[M]+	228.06348	152.9
[M]-	228.06458	152.9

Literature stripe

literature stripe

Patent stripe

patents stripe