![Trimethyl[3-octyl-3-(phenylthio)prop-1-ynyl]silane](/api/spectrum/ApI4VRtww4M/structure.png?h=300&w=458 "Trimethyl[3-octyl-3-(phenylthio)prop-1-ynyl]silane")
| SpectraBase Compound ID | 6GdQDlbd4FH |
|---|---|
| InChI | InChI=1S/C20H32SSi/c1-5-6-7-8-9-11-16-20(17-18-22(2,3)4)21-19-14-12-10-13-15-19/h10,12-15,20H,5-9,11,16H2,1-4H3 |
| InChIKey | MRLFACAYKDAJFE-UHFFFAOYSA-N |
| Mol Weight | 332.6 g/mol |
| Molecular Formula | C20H32SSi |
| Exact Mass | 332.199399 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ApI4VRtww4M |
|---|---|
| Name | Trimethyl[3-octyl-3-(phenylthio)prop-1-ynyl]silane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.199398739 u |
| Formula | C20H32SSi |
| InChI | InChI=1S/C20H32SSi/c1-5-6-7-8-9-11-16-20(17-18-22(2,3)4)21-19-14-12-10-13-15-19/h10,12-15,20H,5-9,11,16H2,1-4H3 |
| InChIKey | MRLFACAYKDAJFE-UHFFFAOYSA-N |
| Molecular Weight | 332.621 g/mol |
| SMILES | C(#C[Si](C)(C)C)C(SC1=CC=CC=C1)CCCCCCCC |