| SpectraBase Compound ID | 6bllgYO6tVL |
|---|---|
| InChI | InChI=1S/C21H37NOS/c1-4-6-7-8-9-10-11-12-16-22(19(3)14-5-2)21(23)18-20-15-13-17-24-20/h13,15,17,19H,4-12,14,16,18H2,1-3H3 |
| InChIKey | BNTDEWCEMHGXFR-UHFFFAOYSA-N |
| Mol Weight | 351.6 g/mol |
| Molecular Formula | C21H37NOS |
| Exact Mass | 351.259586 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4uBWSzJcGg1 |
|---|---|
| Name | Acetamide, 2-(2-thiophenyl)-N-(2-pentyl)-N-decyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.259585988 u |
| Formula | C21H37NOS |
| InChI | InChI=1S/C21H37NOS/c1-4-6-7-8-9-10-11-12-16-22(19(3)14-5-2)21(23)18-20-15-13-17-24-20/h13,15,17,19H,4-12,14,16,18H2,1-3H3 |
| InChIKey | BNTDEWCEMHGXFR-UHFFFAOYSA-N |
| Molecular Weight | 351.593 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)CC=1SC=CC1)CCCCCCCCC |