| SpectraBase Compound ID | G3hLjVgoB3l |
|---|---|
| InChI | InChI=1S/C16H25NO3/c1-4-6-7-8-9-10-11-12-13-15(17-14(3)18)16(19)20-5-2/h11-12,15H,4-8,13H2,1-3H3,(H,17,18)/b12-11+ |
| InChIKey | DECIULORADJCHT-VAWYXSNFSA-N |
| Mol Weight | 279.38 g/mol |
| Molecular Formula | C16H25NO3 |
| Exact Mass | 279.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1fBMLukM1Pd |
|---|---|
| Name | Ethyl 2-(acetamido)dodec-4-en-6-ynoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.183443666 u |
| Formula | C16H25NO3 |
| InChI | InChI=1S/C16H25NO3/c1-4-6-7-8-9-10-11-12-13-15(17-14(3)18)16(19)20-5-2/h11-12,15H,4-8,13H2,1-3H3,(H,17,18)/b12-11+ |
| InChIKey | DECIULORADJCHT-VAWYXSNFSA-N |
| Molecular Weight | 279.380 g/mol |
| SMILES | C(#CCCCCC)\C=C\CC(C(=O)OCC)NC(=O)C |