| SpectraBase Compound ID | BnyzmTOml6Q |
|---|---|
| InChI | InChI=1S/C13H22S/c1-3-5-6-7-9-13-11-10-12(14-13)8-4-2/h10-11H,3-9H2,1-2H3 |
| InChIKey | LXJHSLNORSDGSA-UHFFFAOYSA-N |
| Mol Weight | 210.38 g/mol |
| Molecular Formula | C13H22S |
| Exact Mass | 210.144222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7d6ZhVCMsj4 |
|---|---|
| Name | Thiophene, 2-hexyl-5-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.144221882 u |
| Formula | C13H22S |
| InChI | InChI=1S/C13H22S/c1-3-5-6-7-9-13-11-10-12(14-13)8-4-2/h10-11H,3-9H2,1-2H3 |
| InChIKey | LXJHSLNORSDGSA-UHFFFAOYSA-N |
| Molecular Weight | 210.379 g/mol |
| SMILES | C(CC=1SC(CCC)=CC1)CCCC |