| SpectraBase Compound ID | C1cKt3RQueL |
|---|---|
| InChI | InChI=1S/C16H26O2S/c1-3-4-5-6-10-13-15(17)16(18-2)19-14-11-8-7-9-12-14/h7-9,11-12,15-17H,3-6,10,13H2,1-2H3 |
| InChIKey | PZJBKGHTQAQIBH-UHFFFAOYSA-N |
| Mol Weight | 282.44 g/mol |
| Molecular Formula | C16H26O2S |
| Exact Mass | 282.165351 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | B51SywfM3Rd |
|---|---|
| Name | Anti-1-methoxy-1-(phenylthio)-2-hydroxynonane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.165351249 u |
| Formula | C16H26O2S |
| InChI | InChI=1S/C16H26O2S/c1-3-4-5-6-10-13-15(17)16(18-2)19-14-11-8-7-9-12-14/h7-9,11-12,15-17H,3-6,10,13H2,1-2H3 |
| InChIKey | PZJBKGHTQAQIBH-UHFFFAOYSA-N |
| SMILES | C(SC1=CC=CC=C1)(C(O)CCCCCCC)OC |