| SpectraBase Compound ID | BNpdR65OzTG |
|---|---|
| InChI | InChI=1S/C17H36O4S2/c1-3-5-7-9-11-22-17(23-12-10-8-6-4-2)16(21)15(20)14(19)13-18/h14-21H,3-13H2,1-2H3/t14-,15+,16+/m0/s1 |
| InChIKey | UUJAXMJAXUORFA-UHFFFAOYSA-N |
| Mol Weight | 368.6 g/mol |
| Molecular Formula | C17H36O4S2 |
| Exact Mass | 368.205502 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 94JSqJDC96J |
|---|---|
| Name | D-Lyxose, dihexyl mercaptal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.205501983 u |
| Formula | C17H36O4S2 |
| InChI | InChI=1S/C17H36O4S2/c1-3-5-7-9-11-22-17(23-12-10-8-6-4-2)16(21)15(20)14(19)13-18/h14-21H,3-13H2,1-2H3 |
| InChIKey | UUJAXMJAXUORFA-UHFFFAOYSA-N |
| SMILES | OC(C(C(CO)O)O)C(SCCCCCC)SCCCCCC |