| SpectraBase Compound ID | HeWRWDqTLhB |
|---|---|
| InChI | InChI=1S/C14H21NO4/c1-5-19-13(17)12(15-11(2)16)9-7-6-8-10-14(3,4)18/h6-7,12,18H,5,9H2,1-4H3,(H,15,16)/b7-6+ |
| InChIKey | QGUVBDJZNXBURY-VOTSOKGWSA-N |
| Mol Weight | 267.32 g/mol |
| Molecular Formula | C14H21NO4 |
| Exact Mass | 267.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ku7SZEJcdTO |
|---|---|
| Name | Ethyl 2-acetamido-8-hydroxy-8-methylnon-4-en-6-ynoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.147058156 u |
| Formula | C14H21NO4 |
| InChI | InChI=1S/C14H21NO4/c1-5-19-13(17)12(15-11(2)16)9-7-6-8-10-14(3,4)18/h6-7,12,18H,5,9H2,1-4H3,(H,15,16)/b7-6+ |
| InChIKey | QGUVBDJZNXBURY-VOTSOKGWSA-N |
| Molecular Weight | 267.325 g/mol |
| SMILES | C(#CC(O)(C)C)\C=C\CC(C(=O)OCC)NC(=O)C |