CID 20473

(3-mercaptopropyl)trimethoxysilane

Structural Information

Molecular Formula
C6H16O3SSi
SMILES
CO[Si](CCCS)(OC)OC
InChI
InChI=1S/C6H16O3SSi/c1-7-11(8-2,9-3)6-4-5-10/h10H,4-6H2,1-3H3
InChIKey
UUEWCQRISZBELL-UHFFFAOYSA-N
Compound name
3-trimethoxysilylpropane-1-thiol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

274
References

68372
Patents

196.05894 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.06622 141.7
[M+Na]+ 219.04816 148.6
[M-H]- 195.05166 142.0
[M+NH4]+ 214.09276 162.4
[M+K]+ 235.02210 148.7
[M+H-H2O]+ 179.05620 136.6
[M+HCOO]- 241.05714 158.8
[M+CH3COO]- 255.07279 180.5
[M+Na-2H]- 217.03361 145.3
[M]+ 196.05839 149.2
[M]- 196.05949 149.2
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