| SpectraBase Compound ID | GTY7ZO9weUw |
|---|---|
| InChI | InChI=1S/C21H43NO/c1-5-8-10-11-12-13-14-15-16-19-22(20(4)17-7-3)21(23)18-9-6-2/h20H,5-19H2,1-4H3 |
| InChIKey | XSONCWLCEMMBSJ-UHFFFAOYSA-N |
| Mol Weight | 325.6 g/mol |
| Molecular Formula | C21H43NO |
| Exact Mass | 325.334465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AAiXcvtWOZO |
|---|---|
| Name | Valeramide, N-(2-pentyl)-N-undecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.334465008 u |
| Formula | C21H43NO |
| InChI | InChI=1S/C21H43NO/c1-5-8-10-11-12-13-14-15-16-19-22(20(4)17-7-3)21(23)18-9-6-2/h20H,5-19H2,1-4H3 |
| InChIKey | XSONCWLCEMMBSJ-UHFFFAOYSA-N |
| Molecular Weight | 325.581 g/mol |
| SMILES | C(N(CCCCCCCCCCC)C(CCC)C)(=O)CCCC |