CID 86697

Einecs 242-163-2

Structural Information

Molecular Formula

C₈H₁₃Cl₃Si

SMILES

C1CC(CC=C1)CC[Si](Cl)(Cl)Cl

InChI

InChI=1S/C8H13Cl3Si/c9-12(10,11)7-6-8-4-2-1-3-5-8/h1-2,8H,3-7H2

InChIKey

BACYXSNZANMSGE-UHFFFAOYSA-N

Compound name

trichloro(2-cyclohex-3-en-1-ylethyl)silane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 440
Patents: 241.98521 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]+	242.992486	149.2
[M+Na]+	264.974428	155.9
[M-H]-	240.977934	149.9
[M+NH4]+	260.019033	168.2
[M+K]+	280.948368	150.2
[M+H-H2O]+	224.982470	145.6
[M+HCOO]-	286.983411	153.9
[M+CH3COO]-	300.999061	187.0
[M+Na-2H]-	262.959876	153.1
[M]+	241.98466142	148.5
[M]-	241.98575858	148.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe