CID 17800896

P-(t-butyl)phenethyltrichlorosilane

Structural Information

Molecular Formula

C₁₂H₁₇Cl₃Si

SMILES

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

InChI

InChI=1S/C12H17Cl3Si/c1-12(2,3)11-6-4-10(5-7-11)8-9-16(13,14)15/h4-7H,8-9H2,1-3H3

InChIKey

QWNMCEZWNSHQMT-UHFFFAOYSA-N

Compound name

2-(4-tert-butylphenyl)ethyl-trichlorosilane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 307
Patents: 294.0165 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]+	295.023776	163.0
[M+Na]+	317.005718	171.6
[M-H]-	293.009224	164.7
[M+NH4]+	312.050323	180.8
[M+K]+	332.979658	165.0
[M+H-H2O]+	277.013760	159.4
[M+HCOO]-	339.014701	167.8
[M+CH3COO]-	353.030351	198.6
[M+Na-2H]-	314.991166	167.0
[M]+	294.01595142	166.6
[M]-	294.01704858	166.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe