| SpectraBase Compound ID | BOLTFecLAJ5 |
|---|---|
| InChI | InChI=1S/C12H20O4/c1-10(12(15)16-2)8-6-4-3-5-7-9-11(13)14/h1,3-9H2,2H3,(H,13,14) |
| InChIKey | ZUNJWEGRDSXKIO-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C12H20O4 |
| Exact Mass | 228.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 947CSfNZ2ao |
|---|---|
| Name | 9-Methoxycarbonyldec-9-enoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.136159120 u |
| Formula | C12H20O4 |
| InChI | InChI=1S/C12H20O4/c1-10(12(15)16-2)8-6-4-3-5-7-9-11(13)14/h1,3-9H2,2H3,(H,13,14) |
| InChIKey | ZUNJWEGRDSXKIO-UHFFFAOYSA-N |
| Molecular Weight | 228.288 g/mol |
| SMILES | C(CCCCCCCC(=C)C(=O)OC)(=O)O |