| SpectraBase Compound ID | HwLUc1CIRcp |
|---|---|
| InChI | InChI=1S/C21H35NO/c1-4-7-8-9-10-14-18-22(17-5-2)21(23)20(6-3)19-15-12-11-13-16-19/h11-13,15-16,20H,4-10,14,17-18H2,1-3H3 |
| InChIKey | OOZPYOJNXLBMDR-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 | Llb86pis2xA |
|---|---|
| Name | Butyramide, 2-phenyl-N-propyl-N-octyl- |
| 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/c1-4-7-8-9-10-14-18-22(17-5-2)21(23)20(6-3)19-15-12-11-13-16-19/h11-13,15-16,20H,4-10,14,17-18H2,1-3H3 |
| InChIKey | OOZPYOJNXLBMDR-UHFFFAOYSA-N |
| Molecular Weight | 317.517 g/mol |
| SMILES | C(N(CCC)CCCCCCCC)(=O)C(CC)C1=CC=CC=C1 |