| SpectraBase Compound ID | I5Dpx0YJzIa |
|---|---|
| InChI | InChI=1S/C16H32N2O2S/c1-3-5-7-9-11-17-15(19)13-21-14-16(20)18-12-10-8-6-4-2/h3-14H2,1-2H3,(H,17,19)(H,18,20) |
| InChIKey | OSJLHACWMHPGGT-UHFFFAOYSA-N |
| Mol Weight | 316.5 g/mol |
| Molecular Formula | C16H32N2O2S |
| Exact Mass | 316.218449 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5eg8oidCFXQ |
|---|---|
| Name | N,N'-Dihexyl thiodiglicolic acid amide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.218449450 u |
| Formula | C16H32N2O2S |
| InChI | InChI=1S/C16H32N2O2S/c1-3-5-7-9-11-17-15(19)13-21-14-16(20)18-12-10-8-6-4-2/h3-14H2,1-2H3,(H,17,19)(H,18,20) |
| InChIKey | OSJLHACWMHPGGT-UHFFFAOYSA-N |
| Molecular Weight | 316.504 g/mol |
| SMILES | C(NCCCCCC)(CSCC(NCCCCCC)=O)=O |