CID 2760416

89530-34-7

Structural Information

Molecular Formula

C₁₂H₁₆OSi

SMILES

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

InChI

InChI=1S/C12H16OSi/c1-14(2,3)10-9-12(13)11-7-5-4-6-8-11/h4-8,12-13H,1-3H3

InChIKey

RVTDALNDYLDVMN-UHFFFAOYSA-N

Compound name

1-phenyl-3-trimethylsilylprop-2-yn-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
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	145.9
[M+Na]+	227.08627	157.3
[M+NH4]+	222.13087	150.5
[M+K]+	243.06021	148.3
[M-H]-	203.08977	139.1
[M+Na-2H]-	225.07172	149.0
[M]+	204.09650	144.8
[M]-	204.09760	144.8

Literature stripe

literature stripe

Patent stripe

patents stripe