| SpectraBase Compound ID | K9sw3kUFUtq |
|---|---|
| InChI | InChI=1S/C21H27NO/c1-2-3-10-17-22(18-20-13-8-5-9-14-20)21(23)16-15-19-11-6-4-7-12-19/h4-9,11-14H,2-3,10,15-18H2,1H3 |
| InChIKey | JURBCVJGCCWVTK-UHFFFAOYSA-N |
| Mol Weight | 309.45 g/mol |
| Molecular Formula | C21H27NO |
| Exact Mass | 309.209264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4LawvE6x8A1 |
|---|---|
| Name | Propionamide, 3-phenyl-N-benzyl-N-pentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.209264492 u |
| Formula | C21H27NO |
| InChI | InChI=1S/C21H27NO/c1-2-3-10-17-22(18-20-13-8-5-9-14-20)21(23)16-15-19-11-6-4-7-12-19/h4-9,11-14H,2-3,10,15-18H2,1H3 |
| InChIKey | JURBCVJGCCWVTK-UHFFFAOYSA-N |
| Molecular Weight | 309.453 g/mol |
| SMILES | C(N(CCCCC)CC1=CC=CC=C1)(=O)CCC1=CC=CC=C1 |