| SpectraBase Compound ID | 6lZBsBoIPd3 |
|---|---|
| InChI | InChI=1S/C20H33NO/c1-6-13-21(14-12-18-10-8-7-9-11-18)19(22)15-17(2)16-20(3,4)5/h7-11,17H,6,12-16H2,1-5H3 |
| InChIKey | VHQFJHSFGAZCIO-UHFFFAOYSA-N |
| Mol Weight | 303.5 g/mol |
| Molecular Formula | C20H33NO |
| Exact Mass | 303.256215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3kAnK6VtlVq |
|---|---|
| Name | 3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.256214686 u |
| Formula | C20H33NO |
| InChI | InChI=1S/C20H33NO/c1-6-13-21(14-12-18-10-8-7-9-11-18)19(22)15-17(2)16-20(3,4)5/h7-11,17H,6,12-16H2,1-5H3 |
| InChIKey | VHQFJHSFGAZCIO-UHFFFAOYSA-N |
| SMILES | C(CC(CC(N(CCC)CCC1=CC=CC=C1)=O)C)(C)(C)C |