| SpectraBase Compound ID | IorORaOoBre |
|---|---|
| InChI | InChI=1S/C15H21NO/c1-4-16(15(17)12-13(2)3)11-10-14-8-6-5-7-9-14/h5-9,12H,4,10-11H2,1-3H3 |
| InChIKey | UCQVRKXNTCIWJV-UHFFFAOYSA-N |
| Mol Weight | 231.34 g/mol |
| Molecular Formula | C15H21NO |
| Exact Mass | 231.162314 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KbTJrBARXgm |
|---|---|
| Name | but-2-Enoylamide, 3-methyl-N-(2-phenylethyl)-N-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.162314299 u |
| Formula | C15H21NO |
| InChI | InChI=1S/C15H21NO/c1-4-16(15(17)12-13(2)3)11-10-14-8-6-5-7-9-14/h5-9,12H,4,10-11H2,1-3H3 |
| InChIKey | UCQVRKXNTCIWJV-UHFFFAOYSA-N |
| Molecular Weight | 231.339 g/mol |
| SMILES | C1=CC=CC(=C1)CCN(C(=O)C=C(C)C)CC |