| SpectraBase Compound ID | BjmylsOXe0d |
|---|---|
| InChI | InChI=1S/C16H25NOS/c1-2-3-4-5-6-10-13-17-16(18)14-19-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3,(H,17,18) |
| InChIKey | MPCKYGBFRFSDSP-UHFFFAOYSA-N |
| Mol Weight | 279.44 g/mol |
| Molecular Formula | C16H25NOS |
| Exact Mass | 279.165686 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1hp0VBFvXJy |
|---|---|
| Name | Acetamide, 2-phenylthio-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.165685602 u |
| Formula | C16H25NOS |
| InChI | InChI=1S/C16H25NOS/c1-2-3-4-5-6-10-13-17-16(18)14-19-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3,(H,17,18) |
| InChIKey | MPCKYGBFRFSDSP-UHFFFAOYSA-N |
| Molecular Weight | 279.442 g/mol |
| SMILES | C(=O)(NCCCCCCCC)CSC1=CC=CC=C1 |