| SpectraBase Compound ID | 1lCoivD89Xq |
|---|---|
| InChI | InChI=1S/C12H18Br2S/c1-2-3-4-5-6-7-8-10-9-11(13)15-12(10)14/h9H,2-8H2,1H3 |
| InChIKey | PJGBSUPPENVFAD-UHFFFAOYSA-N |
| Mol Weight | 354.14 g/mol |
| Molecular Formula | C12H18Br2S |
| Exact Mass | 351.949598 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7VJzyZVTpcS |
|---|---|
| Name | 2,5-Dibromo-3-octylthiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.949597754 u |
| Formula | C12H18Br2S |
| InChI | InChI=1S/C12H18Br2S/c1-2-3-4-5-6-7-8-10-9-11(13)15-12(10)14/h9H,2-8H2,1H3 |
| InChIKey | PJGBSUPPENVFAD-UHFFFAOYSA-N |
| Molecular Weight | 354.144 g/mol |
| SMILES | C1(=C(C=C(S1)Br)CCCCCCCC)Br |