| SpectraBase Compound ID | 5sGQdJOjyd7 |
|---|---|
| InChI | InChI=1S/C19H32O6S/c20-6-7-21-8-9-22-10-11-23-12-13-24-14-15-25-16-17-26-18-19-4-2-1-3-5-19/h1-5,20H,6-18H2 |
| InChIKey | URJKTESOUPCLAC-UHFFFAOYSA-N |
| Mol Weight | 388.5 g/mol |
| Molecular Formula | C19H32O6S |
| Exact Mass | 388.19196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2DKhgKnVliM |
|---|---|
| Name | 17-Benzythio-3,6,9,12,15-pentaoxaheptadecanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.191959918 u |
| Formula | C19H32O6S |
| InChI | InChI=1S/C19H32O6S/c20-6-7-21-8-9-22-10-11-23-12-13-24-14-15-25-16-17-26-18-19-4-2-1-3-5-19/h1-5,20H,6-18H2 |
| InChIKey | URJKTESOUPCLAC-UHFFFAOYSA-N |
| Molecular Weight | 388.519 g/mol |
| SMILES | C(SCCOCCOCCOCCOCCOCCO)C1=CC=CC=C1 |