| SpectraBase Compound ID | 3SGlDHobfvY |
|---|---|
| InChI | InChI=1S/C23H42S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-21-20-22(2)24-23/h20-21H,3-19H2,1-2H3 |
| InChIKey | ZPMPFURRLHCWAA-UHFFFAOYSA-N |
| Mol Weight | 350.6 g/mol |
| Molecular Formula | C23H42S |
| Exact Mass | 350.300723 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3EMT4DLgtch |
|---|---|
| Name | 2-Methyl-5-octadecylthiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.300722526 u |
| Formula | C23H42S |
| InChI | InChI=1S/C23H42S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-21-20-22(2)24-23/h20-21H,3-19H2,1-2H3 |
| InChIKey | ZPMPFURRLHCWAA-UHFFFAOYSA-N |
| Molecular Weight | 350.649 g/mol |
| SMILES | C(CCCCCCCCCCCCCCCC)CC1=CC=C(C)S1 |