CID 117484

Trimethylsilyl trichloroacetate

Structural Information

Molecular Formula

C₅H₉Cl₃O₂Si

SMILES

C[Si](C)(C)OC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C5H9Cl3O2Si/c1-11(2,3)10-4(9)5(6,7)8/h1-3H3

InChIKey

HAIZQIKYAKUOBN-UHFFFAOYSA-N

Compound name

trimethylsilyl 2,2,2-trichloroacetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 168
Patents: 233.94374 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]+	234.95102	145.4
[M+Na]+	256.93296	156.4
[M+NH4]+	251.97756	152.7
[M+K]+	272.90690	151.4
[M-H]-	232.93646	142.9
[M+Na-2H]-	254.91841	148.6
[M]+	233.94319	147.0
[M]-	233.94429	147.0

Literature stripe

literature stripe

Patent stripe

patents stripe