CID 2733807

126519-89-9

Structural Information

Molecular Formula

C₁₁H₁₇ClO₅SSi

SMILES

CO[Si](CCC1=CC=C(C=C1)S(=O)(=O)Cl)(OC)OC

InChI

InChI=1S/C11H17ClO5SSi/c1-15-19(16-2,17-3)9-8-10-4-6-11(7-5-10)18(12,13)14/h4-7H,8-9H2,1-3H3

InChIKey

NYIDSUMRGUILGR-UHFFFAOYSA-N

Compound name

4-(2-trimethoxysilylethyl)benzenesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1080
Patents: 324.02545 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]+	325.03273	169.9
[M+Na]+	347.01467	180.6
[M+NH4]+	342.05927	176.1
[M+K]+	362.98861	173.9
[M-H]-	323.01817	169.0
[M+Na-2H]-	345.00012	174.0
[M]+	324.02490	171.9
[M]-	324.02600	171.9

Literature stripe

literature stripe

Patent stripe

patents stripe