| SpectraBase Compound ID | r8bXKESGOg |
|---|---|
| InChI | InChI=1S/C16H25NO4/c1-6-15(18)17-11(3)8-12-9-13(19-4)16(21-7-2)14(10-12)20-5/h9-11H,6-8H2,1-5H3,(H,17,18) |
| InChIKey | QNTQUAQDKZUHSJ-UHFFFAOYSA-N |
| Mol Weight | 295.38 g/mol |
| Molecular Formula | C16H25NO4 |
| Exact Mass | 295.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D1TuCWwdVBr |
|---|---|
| Name | 3C-E Prop |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.178358285 u |
| Formula | C16H25NO4 |
| InChI | InChI=1S/C16H25NO4/c1-6-15(18)17-11(3)8-12-9-13(19-4)16(21-7-2)14(10-12)20-5/h9-11H,6-8H2,1-5H3,(H,17,18) |
| InChIKey | QNTQUAQDKZUHSJ-UHFFFAOYSA-N |
| SMILES | C1(=C(C=C(C=C1OC)CC(NC(CC)=O)C)OC)OCC |