CID 205445

1-trimethylsilanylethynyl-cyclohexanol

Structural Information

Molecular Formula

C₁₁H₂₀OSi

SMILES

C[Si](C)(C)C#CC1(CCCCC1)O

InChI

InChI=1S/C11H20OSi/c1-13(2,3)10-9-11(12)7-5-4-6-8-11/h12H,4-8H2,1-3H3

InChIKey

LHRITDPHGURSFT-UHFFFAOYSA-N

Compound name

1-(2-trimethylsilylethynyl)cyclohexan-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 32
Patents: 196.12834 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]+	197.13562	148.2
[M+Na]+	219.11756	155.9
[M-H]-	195.12106	148.9
[M+NH4]+	214.16216	167.4
[M+K]+	235.09150	151.3
[M+H-H2O]+	179.12560	138.2
[M+HCOO]-	241.12654	159.8
[M+CH3COO]-	255.14219	186.4
[M+Na-2H]-	217.10301	152.2
[M]+	196.12779	138.9
[M]-	196.12889	138.9

Literature stripe

literature stripe

Patent stripe

patents stripe