CID 138395832

Silicic acid, ethyl 2-phenylethyl ester

Structural Information

Molecular Formula

C₁₀H₁₄O₃Si

SMILES

CCO[Si](=O)OCCC1=CC=CC=C1

InChI

InChI=1S/C10H14O3Si/c1-2-12-14(11)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3

InChIKey

RITHFTSNXCSCSK-UHFFFAOYSA-N

Compound name

ethoxy-oxo-(2-phenylethoxy)silane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1
Patents: 210.07123 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]+	211.07851	143.7
[M+Na]+	233.06045	150.2
[M-H]-	209.06395	146.9
[M+NH4]+	228.10505	162.9
[M+K]+	249.03439	149.2
[M+H-H2O]+	193.06849	137.2
[M+HCOO]-	255.06943	167.5
[M+CH3COO]-	269.08508	183.5
[M+Na-2H]-	231.04590	149.5
[M]+	210.07068	147.4
[M]-	210.07178	147.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe