CID 75698

Allyltrimethoxysilane

Structural Information

Molecular Formula

C₆H₁₄O₃Si

SMILES

CO[Si](CC=C)(OC)OC

InChI

InChI=1S/C6H14O3Si/c1-5-6-10(7-2,8-3)9-4/h5H,1,6H2,2-4H3

InChIKey

LFRDHGNFBLIJIY-UHFFFAOYSA-N

Compound name

trimethoxy(prop-2-enyl)silane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 12
References: 21016
Patents: 162.07123 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]+	163.078506	132.5
[M+Na]+	185.060448	140.1
[M-H]-	161.063954	132.9
[M+NH4]+	180.105053	154.2
[M+K]+	201.034388	140.8
[M+H-H2O]+	145.068490	128.3
[M+HCOO]-	207.069431	155.4
[M+CH3COO]-	221.085081	175.7
[M+Na-2H]-	183.045896	139.8
[M]+	162.07068142	137.5
[M]-	162.07177858	137.5

Literature stripe

literature stripe

Patent stripe

patents stripe