CID 82039

Ethanethiol, 2-(trimethoxysilyl)-

Structural Information

Molecular Formula

C₅H₁₄O₃SSi

SMILES

CO[Si](CCS)(OC)OC

InChI

InChI=1S/C5H14O3SSi/c1-6-10(7-2,8-3)5-4-9/h9H,4-5H2,1-3H3

InChIKey

LOSLJXKHQKRRFN-UHFFFAOYSA-N

Compound name

2-trimethoxysilylethanethiol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 7682
Patents: 182.04329 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]+	183.05057	137.1
[M+Na]+	205.03251	144.5
[M-H]-	181.03601	137.6
[M+NH4]+	200.07711	158.4
[M+K]+	221.00645	144.9
[M+H-H2O]+	165.04055	132.3
[M+HCOO]-	227.04149	154.6
[M+CH3COO]-	241.05714	177.5
[M+Na-2H]-	203.01796	141.2
[M]+	182.04274	144.3
[M]-	182.04384	144.3

Literature stripe

literature stripe

Patent stripe

patents stripe