CID 170839670

Schembl23701116

Structural Information

Molecular Formula

C₉H₁₃ClOSi

SMILES

C1=CC=C(C=C1)[SiH2]COCCCl

InChI

InChI=1S/C9H13ClOSi/c10-6-7-11-8-12-9-4-2-1-3-5-9/h1-5H,6-8,12H2

InChIKey

IIOPHKRILBMIHL-UHFFFAOYSA-N

Compound name

2-chloroethoxymethyl(phenyl)silane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 200.04242 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]+	201.04970	139.6
[M+Na]+	223.03164	147.3
[M-H]-	199.03514	142.6
[M+NH4]+	218.07624	160.3
[M+K]+	239.00558	143.7
[M+H-H2O]+	183.03968	134.4
[M+HCOO]-	245.04062	159.4
[M+CH3COO]-	259.05627	180.5
[M+Na-2H]-	221.01709	146.7
[M]+	200.04187	143.3
[M]-	200.04297	143.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe