CID 75690

Benzyltriethoxysilane

Structural Information

Molecular Formula

C₁₃H₂₂O₃Si

SMILES

CCO[Si](CC1=CC=CC=C1)(OCC)OCC

InChI

InChI=1S/C13H22O3Si/c1-4-14-17(15-5-2,16-6-3)12-13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3

InChIKey

CPLASELWOOUNGW-UHFFFAOYSA-N

Compound name

benzyl(triethoxy)silane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 3418
Patents: 254.13382 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]+	255.14110	159.1
[M+Na]+	277.12304	164.6
[M-H]-	253.12654	161.8
[M+NH4]+	272.16764	176.7
[M+K]+	293.09698	163.5
[M+H-H2O]+	237.13108	152.4
[M+HCOO]-	299.13202	181.0
[M+CH3COO]-	313.14767	193.0
[M+Na-2H]-	275.10849	165.1
[M]+	254.13327	164.7
[M]-	254.13437	164.7

Literature stripe

literature stripe

Patent stripe

patents stripe