CID 70601

Butyltrimethoxysilane

Structural Information

Molecular Formula

C₇H₁₈O₃Si

SMILES

CCCC[Si](OC)(OC)OC

InChI

InChI=1S/C7H18O3Si/c1-5-6-7-11(8-2,9-3)10-4/h5-7H2,1-4H3

InChIKey

SXPLZNMUBFBFIA-UHFFFAOYSA-N

Compound name

butyl(trimethoxy)silane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 4
References: 20239
Patents: 178.10252 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]+	179.109796	138.9
[M+Na]+	201.091738	145.7
[M-H]-	177.095244	139.0
[M+NH4]+	196.136343	160.0
[M+K]+	217.065678	146.8
[M+H-H2O]+	161.099780	134.3
[M+HCOO]-	223.100721	161.2
[M+CH3COO]-	237.116371	179.7
[M+Na-2H]-	199.077186	145.6
[M]+	178.10197142	145.0
[M]-	178.10306858	145.0

Literature stripe

literature stripe

Patent stripe

patents stripe