CID 90091

Trimethylsilyl 4-(triethoxysilyl)butyrate

Structural Information

Molecular Formula
C13H30O5Si2
SMILES
CCO[Si](CCCC(=O)O[Si](C)(C)C)(OCC)OCC
InChI
InChI=1S/C13H30O5Si2/c1-7-15-20(16-8-2,17-9-3)12-10-11-13(14)18-19(4,5)6/h7-12H2,1-6H3
InChIKey
MQVJMBRYTYHBNW-UHFFFAOYSA-N
Compound name
trimethylsilyl 4-triethoxysilylbutanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.16318 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.17046 176.4
[M+Na]+ 345.15240 180.6
[M-H]- 321.15590 175.5
[M+NH4]+ 340.19700 192.1
[M+K]+ 361.12634 181.3
[M+H-H2O]+ 305.16044 170.8
[M+HCOO]- 367.16138 194.4
[M+CH3COO]- 381.17703 204.5
[M+Na-2H]- 343.13785 179.4
[M]+ 322.16263 186.1
[M]- 322.16373 186.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.