PubChemLite - D4 tetra-ethyl triethoxysilane (C36H88O16Si8)

Structural Information

Molecular Formula

SMILES

CCO[Si](CC[Si]1(O[Si](O[Si](O[Si](O1)(C)CC[Si](OCC)(OCC)OCC)(C)CC[Si](OCC)(OCC)OCC)(C)CC[Si](OCC)(OCC)OCC)C)(OCC)OCC

InChI

InChI=1S/C36H88O16Si8/c1-17-37-57(38-18-2,39-19-3)33-29-53(13)49-54(14,30-34-58(40-20-4,41-21-5)42-22-6)51-56(16,32-36-60(46-26-10,47-27-11)48-28-12)52-55(15,50-53)31-35-59(43-23-7,44-24-8)45-25-9/h17-36H2,1-16H3

InChIKey

WSHQCIQLWZPNQZ-UHFFFAOYSA-N

Compound name

triethoxy-[2-[2,4,6,8-tetramethyl-4,6,8-tris(2-triethoxysilylethyl)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane

Related CIDs

2D Structure

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]+	1001.4299	337.7
[M+Na]+	1023.4119	339.9
[M-H]-	999.41539	340.5
[M+NH4]+	1018.4565	346.4
[M+K]+	1039.3858	342.7
[M+H-H2O]+	983.41993	339.2
[M+HCOO]-	1045.4209	349.0
[M+CH3COO]-	1059.4365	275.0
[M+Na-2H]-	1021.3973	330.1
[M]+	1000.4221	343.7
[M]-	1000.4232	343.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

1001.4299

337.7

[M+Na]+

1023.4119

339.9

[M-H]-

999.41539

340.5

[M+NH4]+

1018.4565

346.4

[M+K]+

1039.3858

342.7

[M+H-H2O]+

983.41993

339.2

[M+HCOO]-

1045.4209

349.0

[M+CH3COO]-

1059.4365

275.0

[M+Na-2H]-

1021.3973

330.1

[M]+

1000.4221

343.7

[M]-

1000.4232

343.7

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

D4 tetra-ethyl triethoxysilane

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe