CID 20111954

2,2-dimethoxy-1-thia-2-silacyclopentane

Structural Information

Molecular Formula

C₅H₁₂O₂SSi

SMILES

CO[Si]1(CCCS1)OC

InChI

InChI=1S/C5H12O2SSi/c1-6-9(7-2)5-3-4-8-9/h3-5H2,1-2H3

InChIKey

LVTKZSMLKHTKTB-UHFFFAOYSA-N

Compound name

2,2-dimethoxythiasilolane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 191
Patents: 164.03273 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]+	165.040006	131.5
[M+Na]+	187.021948	139.0
[M-H]-	163.025454	135.1
[M+NH4]+	182.066553	156.9
[M+K]+	202.995888	139.0
[M+H-H2O]+	147.029990	127.3
[M+HCOO]-	209.030931	149.9
[M+CH3COO]-	223.046581	170.9
[M+Na-2H]-	185.007396	134.8
[M]+	164.03218142	133.7
[M]-	164.03327858	133.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe