CID 2733807

2-(4-chlorosulfonylphenyl)ethyltrimethoxysilane, 50% in methylene chloride

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

1393
Patents

324.02545 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.03273 166.9
[M+Na]+ 347.01467 175.1
[M-H]- 323.01817 170.8
[M+NH4]+ 342.05927 183.2
[M+K]+ 362.98861 172.1
[M+H-H2O]+ 307.02271 161.7
[M+HCOO]- 369.02365 179.0
[M+CH3COO]- 383.03930 198.5
[M+Na-2H]- 345.00012 171.4
[M]+ 324.02490 177.0
[M]- 324.02600 177.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe