| SpectraBase Compound ID | 2wcyG1WrdK1 |
|---|---|
| InChI | InChI=1S/C14H24O3/c1-14(2,3)13(16)17-12-10-8-6-4-5-7-9-11-15/h4-5,11H,6-10,12H2,1-3H3/b5-4+ |
| InChIKey | WURVHRALDHFXRO-SNAWJCMRSA-N |
| Mol Weight | 240.34 g/mol |
| Molecular Formula | C14H24O3 |
| Exact Mass | 240.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2i8kv5jeN0n |
|---|---|
| Name | (E)-9-Oxonon-5-enyl 2,2-dimethylpropanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.172544630 u |
| Formula | C14H24O3 |
| InChI | InChI=1S/C14H24O3/c1-14(2,3)13(16)17-12-10-8-6-4-5-7-9-11-15/h4-5,11H,6-10,12H2,1-3H3/b5-4+ |
| InChIKey | WURVHRALDHFXRO-SNAWJCMRSA-N |
| Molecular Weight | 240.343 g/mol |
| SMILES | C(C(C)(C)C)(=O)OCCCC\C=C\CCC=O |