CID 62449

3-chloropropyltrimethoxysilane

Structural Information

Molecular Formula

C₆H₁₅ClO₃Si

SMILES

CO[Si](CCCCl)(OC)OC

InChI

InChI=1S/C6H15ClO3Si/c1-8-11(9-2,10-3)6-4-5-7/h4-6H2,1-3H3

InChIKey

OXYZDRAJMHGSMW-UHFFFAOYSA-N

Compound name

3-chloropropyl(trimethoxy)silane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 32
References: 59442
Patents: 198.0479 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]+	199.05518	139.4
[M+Na]+	221.03712	147.4
[M-H]-	197.04062	139.6
[M+NH4]+	216.08172	160.5
[M+K]+	237.01106	146.5
[M+H-H2O]+	181.04516	135.8
[M+HCOO]-	243.04610	157.5
[M+CH3COO]-	257.06175	180.6
[M+Na-2H]-	219.02257	146.2
[M]+	198.04735	146.7
[M]-	198.04845	146.7

Literature stripe

literature stripe

Patent stripe

patents stripe