CID 4407093

40230-92-0

Structural Information

Molecular Formula

C₁₂H₁₆OSi

SMILES

COC1=CC=CC(=C1)C#C[Si](C)(C)C

InChI

InChI=1S/C12H16OSi/c1-13-12-7-5-6-11(10-12)8-9-14(2,3)4/h5-7,10H,1-4H3

InChIKey

QTRRBVKHHBFICK-UHFFFAOYSA-N

Compound name

2-(3-methoxyphenyl)ethynyl-trimethylsilane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 54
Patents: 204.09705 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]+	205.10433	144.0
[M+Na]+	227.08627	156.6
[M+NH4]+	222.13087	149.1
[M+K]+	243.06021	146.9
[M-H]-	203.08977	138.0
[M+Na-2H]-	225.07172	148.0
[M]+	204.09650	143.5
[M]-	204.09760	143.5

Literature stripe

literature stripe

Patent stripe

patents stripe