PubChemLite - Dtxsid40893655 (C23H54O7Si5)

Structural Information

Molecular Formula

SMILES

CCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCOCCOC(=O)C(=C)C

InChI

InChI=1S/C23H54O7Si5/c1-14-15-20-31(4,5)27-33(8,9)29-35(12,13)30-34(10,11)28-32(6,7)21-16-17-25-18-19-26-23(24)22(2)3/h2,14-21H2,1,3-13H3

InChIKey

NEWDMEQZRLPOKM-UHFFFAOYSA-N

Compound name

2-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethyl 2-methylprop-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]+	583.27888	228.7
[M+Na]+	605.26082	233.5
[M-H]-	581.26432	231.1
[M+NH4]+	600.30542	241.1
[M+K]+	621.23476	237.9
[M+H-H2O]+	565.26886	222.2
[M+HCOO]-	627.26980	242.3
[M+CH3COO]-	641.28545	247.7
[M+Na-2H]-	603.24627	217.4
[M]+	582.27105	236.7
[M]-	582.27215	236.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

583.27888

228.7

[M+Na]+

605.26082

233.5

[M-H]-

581.26432

231.1

[M+NH4]+

600.30542

241.1

[M+K]+

621.23476

237.9

[M+H-H2O]+

565.26886

222.2

[M+HCOO]-

627.26980

242.3

[M+CH3COO]-

641.28545

247.7

[M+Na-2H]-

603.24627

217.4

[M]+

582.27105

236.7

[M]-

582.27215

236.7

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

Dtxsid40893655

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe