CID 87622

Isobutyltrimethoxysilane

Structural Information

Molecular Formula
C7H18O3Si
SMILES
CC(C)C[Si](OC)(OC)OC
InChI
InChI=1S/C7H18O3Si/c1-7(2)6-11(8-3,9-4)10-5/h7H,6H2,1-5H3
InChIKey
XYJRNCYWTVGEEG-UHFFFAOYSA-N
Compound name
trimethoxy(2-methylpropyl)silane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

19593
Patents

178.10252 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.109796 138.8
[M+Na]+ 201.091738 145.4
[M-H]- 177.095244 139.0
[M+NH4]+ 196.136343 159.9
[M+K]+ 217.065678 147.0
[M+H-H2O]+ 161.099780 134.3
[M+HCOO]- 223.100721 160.1
[M+CH3COO]- 237.116371 180.5
[M+Na-2H]- 199.077186 144.2
[M]+ 178.10197142 144.2
[M]- 178.10306858 144.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe