| SpectraBase Compound ID | IFkr0cV2Hvu |
|---|---|
| InChI | InChI=1S/C20H31NO2/c1-4-7-9-15-19(22)21(20(23)16-10-8-5-2)18-14-12-11-13-17(18)6-3/h11-14H,4-10,15-16H2,1-3H3 |
| InChIKey | VWMSWGUWZXNEGV-UHFFFAOYSA-N |
| Mol Weight | 317.47 g/mol |
| Molecular Formula | C20H31NO2 |
| Exact Mass | 317.235479 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9jJGlmSa6Yj |
|---|---|
| Name | Hexanamide, N-hexanoyl-N-(2-ethylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.235479240 u |
| Formula | C20H31NO2 |
| InChI | InChI=1S/C20H31NO2/c1-4-7-9-15-19(22)21(20(23)16-10-8-5-2)18-14-12-11-13-17(18)6-3/h11-14H,4-10,15-16H2,1-3H3 |
| InChIKey | VWMSWGUWZXNEGV-UHFFFAOYSA-N |
| Molecular Weight | 317.473 g/mol |
| SMILES | C1(=C(C=CC=C1)CC)N(C(CCCCC)=O)C(CCCCC)=O |