PubChemLite - 2,4,6,8-tetramethyl-2,4,6,8-tetrakis(3-(oxiranylmethoxy)propyl)cyclotetrasiloxane (C28H56O12Si4)

Structural Information

Molecular Formula

SMILES

C[Si]1(O[Si](O[Si](O[Si](O1)(C)CCCOCC2CO2)(C)CCCOCC3CO3)(C)CCCOCC4CO4)CCCOCC5CO5

InChI

InChI=1S/C28H56O12Si4/c1-41(13-5-9-29-17-25-21-33-25)37-42(2,14-6-10-30-18-26-22-34-26)39-44(4,16-8-12-32-20-28-24-36-28)40-43(3,38-41)15-7-11-31-19-27-23-35-27/h25-28H,5-24H2,1-4H3

InChIKey

BLZDTVROPKIJLZ-UHFFFAOYSA-N

Compound name

2,4,6,8-tetramethyl-2,4,6,8-tetrakis[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

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]+	697.29218	156.5
[M+Na]+	719.27412	154.9
[M-H]-	695.27762	160.1
[M+NH4]+	714.31872	151.6
[M+K]+	735.24806	162.5
[M+H-H2O]+	679.28216	155.5
[M+HCOO]-	741.28310	154.9
[M+CH3COO]-	755.29875	255.3
[M+Na-2H]-	717.25957	155.5
[M]+	696.28435	162.9
[M]-	696.28545	162.9

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

697.29218

156.5

[M+Na]+

719.27412

154.9

[M-H]-

695.27762

160.1

[M+NH4]+

714.31872

151.6

[M+K]+

735.24806

162.5

[M+H-H2O]+

679.28216

155.5

[M+HCOO]-

741.28310

154.9

[M+CH3COO]-

755.29875

255.3

[M+Na-2H]-

717.25957

155.5

[M]+

696.28435

162.9

[M]-

696.28545

162.9

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

2,4,6,8-tetramethyl-2,4,6,8-tetrakis(3-(oxiranylmethoxy)propyl)cyclotetrasiloxane

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe