PubChemLite - Methyltris(tri-sec-butoxysilyloxy)silane (C37H84O12Si4)

Structural Information

Molecular Formula

SMILES

CCC(C)O[Si](OC(C)CC)(OC(C)CC)O[Si](C)(O[Si](OC(C)CC)(OC(C)CC)OC(C)CC)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC

InChI

InChI=1S/C37H84O12Si4/c1-20-29(10)38-51(39-30(11)21-2,40-31(12)22-3)47-50(19,48-52(41-32(13)23-4,42-33(14)24-5)43-34(15)25-6)49-53(44-35(16)26-7,45-36(17)27-8)46-37(18)28-9/h29-37H,20-28H2,1-19H3

InChIKey

JTMGSJWZRADOSX-UHFFFAOYSA-N

Compound name

tributan-2-yl [methyl-bis[tri(butan-2-yloxy)silyloxy]silyl] silicate

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]+	833.51125	290.6
[M+Na]+	855.49319	292.6
[M-H]-	831.49669	296.9
[M+NH4]+	850.53779	314.6
[M+K]+	871.46713	305.2
[M+H-H2O]+	815.50123	288.7
[M+HCOO]-	877.50217	279.0
[M+CH3COO]-	891.51782	295.7
[M+Na-2H]-	853.47864	275.0
[M]+	832.50342	303.3
[M]-	832.50452	303.3

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

833.51125

290.6

[M+Na]+

855.49319

292.6

[M-H]-

831.49669

296.9

[M+NH4]+

850.53779

314.6

[M+K]+

871.46713

305.2

[M+H-H2O]+

815.50123

288.7

[M+HCOO]-

877.50217

279.0

[M+CH3COO]-

891.51782

295.7

[M+Na-2H]-

853.47864

275.0

[M]+

832.50342

303.3

[M]-

832.50452

303.3

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

Methyltris(tri-sec-butoxysilyloxy)silane

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe