| SpectraBase Compound ID | 5sseZnsFsXa |
|---|---|
| InChI | InChI=1S/C8H10BrNOS/c1-2-5-10-8(11)6-3-4-7(9)12-6/h3-4H,2,5H2,1H3,(H,10,11) |
| InChIKey | YRLNOXHJFHHLRC-UHFFFAOYSA-N |
| Mol Weight | 248.14 g/mol |
| Molecular Formula | C8H10BrNOS |
| Exact Mass | 246.966648 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DdwIomE5tAT |
|---|---|
| Name | 5-Bromo-N-propylthiophene-2-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.966648119 u |
| Formula | C8H10BrNOS |
| InChI | InChI=1S/C8H10BrNOS/c1-2-5-10-8(11)6-3-4-7(9)12-6/h3-4H,2,5H2,1H3,(H,10,11) |
| InChIKey | YRLNOXHJFHHLRC-UHFFFAOYSA-N |
| Molecular Weight | 248.138 g/mol |
| SMILES | C1(=CC=C(S1)Br)C(=O)NCCC |