| SpectraBase Compound ID | Ay2i1jrD8J0 |
|---|---|
| InChI | InChI=1S/C20H27NOS/c1-2-3-4-5-9-14-21(17-18-11-7-6-8-12-18)20(22)16-19-13-10-15-23-19/h6-8,10-13,15H,2-5,9,14,16-17H2,1H3 |
| InChIKey | QPGWRADGMFJZLD-UHFFFAOYSA-N |
| Mol Weight | 329.5 g/mol |
| Molecular Formula | C20H27NOS |
| Exact Mass | 329.181336 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GfmT7Qj8FUn |
|---|---|
| Name | Acetamide, 2-(2-thiophenyl)-N-benzyl-N-heptyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.181335666 u |
| Formula | C20H27NOS |
| InChI | InChI=1S/C20H27NOS/c1-2-3-4-5-9-14-21(17-18-11-7-6-8-12-18)20(22)16-19-13-10-15-23-19/h6-8,10-13,15H,2-5,9,14,16-17H2,1H3 |
| InChIKey | QPGWRADGMFJZLD-UHFFFAOYSA-N |
| Molecular Weight | 329.502 g/mol |
| SMILES | C(N(CCCCCCC)CC1=CC=CC=C1)(=O)CC=1SC=CC1 |