| SpectraBase Compound ID | BRXMBTFSTeR |
|---|---|
| InChI | InChI=1S/C21H35NO/c1-2-3-4-5-6-7-8-9-13-19-22-21(23)18-14-17-20-15-11-10-12-16-20/h10-12,15-16H,2-9,13-14,17-19H2,1H3,(H,22,23) |
| InChIKey | PJVDLZTYASWZDI-UHFFFAOYSA-N |
| Mol Weight | 317.5 g/mol |
| Molecular Formula | C21H35NO |
| Exact Mass | 317.271865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D6yhYeSl7CS |
|---|---|
| Name | Butyramide, 4-phenyl-N-undecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.271864750 u |
| Formula | C21H35NO |
| InChI | InChI=1S/C21H35NO/c1-2-3-4-5-6-7-8-9-13-19-22-21(23)18-14-17-20-15-11-10-12-16-20/h10-12,15-16H,2-9,13-14,17-19H2,1H3,(H,22,23) |
| InChIKey | PJVDLZTYASWZDI-UHFFFAOYSA-N |
| Molecular Weight | 317.517 g/mol |
| SMILES | C(NCCCCCCCCCCC)(=O)CCCC1=CC=CC=C1 |