CID 15261877

168065-22-3

Structural Information

Molecular Formula

C₁₀H₂₀O₂Si

SMILES

CC(C)(C)[Si](C)(C)OCC(C#C)O

InChI

InChI=1S/C10H20O2Si/c1-7-9(11)8-12-13(5,6)10(2,3)4/h1,9,11H,8H2,2-6H3

InChIKey

RSIBPEBNXDSOJQ-UHFFFAOYSA-N

Compound name

1-[tert-butyl(dimethyl)silyl]oxybut-3-yn-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 200.12326 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]+	201.13054	148.6
[M+Na]+	223.11248	156.4
[M-H]-	199.11598	147.2
[M+NH4]+	218.15708	166.1
[M+K]+	239.08642	155.4
[M+H-H2O]+	183.12052	138.9
[M+HCOO]-	245.12146	160.8
[M+CH3COO]-	259.13711	191.0
[M+Na-2H]-	221.09793	151.9
[M]+	200.12271	145.0
[M]-	200.12381	145.0

Literature stripe

literature stripe

Patent stripe

patents stripe