| SpectraBase Compound ID | Hodrc2rwVXH |
|---|---|
| InChI | InChI=1S/C13H24O2/c1-6-7-8-9-10-11(2)15-12(14)13(3,4)5/h9-11H,6-8H2,1-5H3/b10-9+ |
| InChIKey | CIYFYDOFPMJDQX-MDZDMXLPSA-N |
| Mol Weight | 212.33 g/mol |
| Molecular Formula | C13H24O2 |
| Exact Mass | 212.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A2PHv3IxYuH |
|---|---|
| Name | 2,2-Dimethylpropanoic acid, oct-3-en-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.177630011 u |
| Formula | C13H24O2 |
| InChI | InChI=1S/C13H24O2/c1-6-7-8-9-10-11(2)15-12(14)13(3,4)5/h9-11H,6-8H2,1-5H3/b10-9+ |
| InChIKey | CIYFYDOFPMJDQX-MDZDMXLPSA-N |
| Molecular Weight | 212.333 g/mol |
| SMILES | C(C(=O)OC(\C=C\CCCC)C)(C)(C)C |