| SpectraBase Compound ID | KeXIvHD3QGu |
|---|---|
| InChI | InChI=1S/C21H29NOS/c1-2-3-4-5-6-10-15-22(18-19-12-8-7-9-13-19)21(23)17-20-14-11-16-24-20/h7-9,11-14,16H,2-6,10,15,17-18H2,1H3 |
| InChIKey | FIWBSIKCUYBZMH-UHFFFAOYSA-N |
| Mol Weight | 343.53 g/mol |
| Molecular Formula | C21H29NOS |
| Exact Mass | 343.196986 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HjeBLoS21pJ |
|---|---|
| Name | Acetamide, 2-(2-thiophenyl)-N-benzyl-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.196985731 u |
| Formula | C21H29NOS |
| InChI | InChI=1S/C21H29NOS/c1-2-3-4-5-6-10-15-22(18-19-12-8-7-9-13-19)21(23)17-20-14-11-16-24-20/h7-9,11-14,16H,2-6,10,15,17-18H2,1H3 |
| InChIKey | FIWBSIKCUYBZMH-UHFFFAOYSA-N |
| Molecular Weight | 343.529 g/mol |
| SMILES | C(N(CCCCCCCC)CC1=CC=CC=C1)(=O)CC=1SC=CC1 |