| SpectraBase Compound ID | 8nhBZyyZVN5 |
|---|---|
| InChI | InChI=1S/C21H35NO/c1-6-7-14-22(15-13-19-11-9-8-10-12-19)20(23)16-18(2)17-21(3,4)5/h8-12,18H,6-7,13-17H2,1-5H3 |
| InChIKey | SIKRHEGQEVRDEN-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 | 9rGXax5kkaP |
|---|---|
| Name | 3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-butyl- |
| 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/c1-6-7-14-22(15-13-19-11-9-8-10-12-19)20(23)16-18(2)17-21(3,4)5/h8-12,18H,6-7,13-17H2,1-5H3 |
| InChIKey | SIKRHEGQEVRDEN-UHFFFAOYSA-N |
| Molecular Weight | 317.517 g/mol |
| SMILES | C(CC(CC(N(CCCC)CCC1=CC=CC=C1)=O)C)(C)(C)C |