PubChemLite - Einecs 275-615-2 (C28H48O12Si4)

Structural Information

Molecular Formula

SMILES

C[Si]1(O[Si](O[Si](O[Si](O1)(C)CCCOC(=O)C=C)(C)CCCOC(=O)C=C)(C)CCCOC(=O)C=C)CCCOC(=O)C=C

InChI

InChI=1S/C28H48O12Si4/c1-9-25(29)33-17-13-21-41(5)37-42(6,22-14-18-34-26(30)10-2)39-44(8,24-16-20-36-28(32)12-4)40-43(7,38-41)23-15-19-35-27(31)11-3/h9-12H,1-4,13-24H2,5-8H3

InChIKey

CUHKVBVNLQPDQC-UHFFFAOYSA-N

Compound name

3-[2,4,6,8-tetramethyl-4,6,8-tris(3-prop-2-enoyloxypropyl)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]propyl prop-2-enoate

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]+	689.22958	313.7
[M+Na]+	711.21152	320.6
[M-H]-	687.21502	318.0
[M+NH4]+	706.25612	322.4
[M+K]+	727.18546	318.7
[M+H-H2O]+	671.21956	221.0
[M+HCOO]-	733.22050	324.9
[M+CH3COO]-	747.23615	256.7
[M+Na-2H]-	709.19697	219.4
[M]+	688.22175	315.9
[M]-	688.22285	315.9

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

689.22958

313.7

[M+Na]+

711.21152

320.6

[M-H]-

687.21502

318.0

[M+NH4]+

706.25612

322.4

[M+K]+

727.18546

318.7

[M+H-H2O]+

671.21956

221.0

[M+HCOO]-

733.22050

324.9

[M+CH3COO]-

747.23615

256.7

[M+Na-2H]-

709.19697

219.4

[M]+

688.22175

315.9

[M]-

688.22285

315.9

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

Einecs 275-615-2

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe