| SpectraBase Compound ID | LDjh9UnB9ps |
|---|---|
| InChI | InChI=1S/C8H16S/c1-4-6-9-7-5-8(2)3/h4,8H,1,5-7H2,2-3H3 |
| InChIKey | HRXAJCHKZNYTMX-UHFFFAOYSA-N |
| Mol Weight | 144.28 g/mol |
| Molecular Formula | C8H16S |
| Exact Mass | 144.097272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KDvDTumCkO |
|---|---|
| Name | Allyl (3-methylbutyl) sulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.097271689 u |
| Formula | C8H16S |
| InChI | InChI=1S/C8H16S/c1-4-6-9-7-5-8(2)3/h4,8H,1,5-7H2,2-3H3 |
| InChIKey | HRXAJCHKZNYTMX-UHFFFAOYSA-N |
| Molecular Weight | 144.276 g/mol |
| SMILES | CC(CCSCC=C)C |