CID 22559815

52217-60-4

Structural Information

Molecular Formula

C₂₀H₄₆O₆Si₂

SMILES

CCO[Si](CCCCCCCC[Si](OCC)(OCC)OCC)(OCC)OCC

InChI

InChI=1S/C20H46O6Si2/c1-7-21-27(22-8-2,23-9-3)19-17-15-13-14-16-18-20-28(24-10-4,25-11-5)26-12-6/h7-20H2,1-6H3

InChIKey

OSAJVUUALHWJEM-UHFFFAOYSA-N

Compound name

triethoxy(8-triethoxysilyloctyl)silane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1690
Patents: 438.2833 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]+	439.29058	212.4
[M+Na]+	461.27252	217.0
[M-H]-	437.27602	203.7
[M+NH4]+	456.31712	215.6
[M+K]+	477.24646	212.9
[M+H-H2O]+	421.28056	204.8
[M+HCOO]-	483.28150	228.8
[M+CH3COO]-	497.29715	227.7
[M+Na-2H]-	459.25797	213.0
[M]+	438.28275	216.7
[M]-	438.28385	216.7

Literature stripe

literature stripe

Patent stripe

patents stripe