CID 104075

(3-bromopropyl)triethoxysilane

Structural Information

Molecular Formula

C₉H₂₁BrO₃Si

SMILES

CCO[Si](CCCBr)(OCC)OCC

InChI

InChI=1S/C9H21BrO3Si/c1-4-11-14(12-5-2,13-6-3)9-7-8-10/h4-9H2,1-3H3

InChIKey

JMFBXUMHVSZUKY-UHFFFAOYSA-N

Compound name

3-bromopropyl(triethoxy)silane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1262
Patents: 284.04434 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]+	285.05162	159.2
[M+Na]+	307.03356	168.5
[M-H]-	283.03706	161.5
[M+NH4]+	302.07816	179.5
[M+K]+	323.00750	159.0
[M+H-H2O]+	267.04160	159.0
[M+HCOO]-	329.04254	178.2
[M+CH3COO]-	343.05819	195.4
[M+Na-2H]-	305.01901	165.5
[M]+	284.04379	183.7
[M]-	284.04489	183.7

Literature stripe

literature stripe

Patent stripe

patents stripe