CID 54243104

3-(trimethylsilyl)propane-1-sulfonyl chloride

Structural Information

Molecular Formula

C₆H₁₅ClO₂SSi

SMILES

C[Si](C)(C)CCCS(=O)(=O)Cl

InChI

InChI=1S/C6H15ClO2SSi/c1-11(2,3)6-4-5-10(7,8)9/h4-6H2,1-3H3

InChIKey

QRJQZRITYCDKTH-UHFFFAOYSA-N

Compound name

3-trimethylsilylpropane-1-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 214.02505 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]+	215.03233	142.2
[M+Na]+	237.01427	150.8
[M-H]-	213.01777	143.1
[M+NH4]+	232.05887	163.2
[M+K]+	252.98821	147.7
[M+H-H2O]+	197.02231	139.1
[M+HCOO]-	259.02325	153.5
[M+CH3COO]-	273.03890	181.1
[M+Na-2H]-	234.99972	146.2
[M]+	214.02450	148.0
[M]-	214.02560	148.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe