CID 87509

18204-80-3

Structural Information

Molecular Formula

C₄H₇Cl₃O₂Si

SMILES

CC(=O)OCC[Si](Cl)(Cl)Cl

InChI

InChI=1S/C4H7Cl3O2Si/c1-4(8)9-2-3-10(5,6)7/h2-3H2,1H3

InChIKey

DPFKBFAYVWIVRK-UHFFFAOYSA-N

Compound name

2-trichlorosilylethyl acetate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 338
Patents: 219.92809 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]+	220.93537	137.1
[M+Na]+	242.91731	146.3
[M-H]-	218.92081	136.3
[M+NH4]+	237.96191	157.4
[M+K]+	258.89125	142.3
[M+H-H2O]+	202.92535	135.7
[M+HCOO]-	264.92629	144.4
[M+CH3COO]-	278.94194	182.4
[M+Na-2H]-	240.90276	141.9
[M]+	219.92754	141.4
[M]-	219.92864	141.4

Literature stripe

literature stripe

Patent stripe

patents stripe