CID 170789

49539-88-0

Structural Information

Molecular Formula

C₁₁H₁₈O₃Si

SMILES

CO[Si](CCC1=CC=CC=C1)(OC)OC

InChI

InChI=1S/C11H18O3Si/c1-12-15(13-2,14-3)10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3

InChIKey

UBMUZYGBAGFCDF-UHFFFAOYSA-N

Compound name

trimethoxy(2-phenylethyl)silane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 5424
Patents: 226.10252 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

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]+	227.10980	149.7
[M+Na]+	249.09174	156.1
[M-H]-	225.09524	152.9
[M+NH4]+	244.13634	168.5
[M+K]+	265.06568	155.4
[M+H-H2O]+	209.09978	143.5
[M+HCOO]-	271.10072	172.3
[M+CH3COO]-	285.11637	187.0
[M+Na-2H]-	247.07719	156.8
[M]+	226.10197	154.6
[M]-	226.10307	154.6

Literature stripe

literature stripe

Patent stripe

patents stripe