| SpectraBase Compound ID | 1rwLNuCJcWD |
|---|---|
| InChI | InChI=1S/C13H22O4/c1-11(13(15)17-3)9-7-5-4-6-8-10-12(14)16-2/h1,4-10H2,2-3H3 |
| InChIKey | ICOIIDMPNQDVKB-UHFFFAOYSA-N |
| Mol Weight | 242.31 g/mol |
| Molecular Formula | C13H22O4 |
| Exact Mass | 242.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EqVtJyqtB32 |
|---|---|
| Name | 9-Methoxycarbonyldec-9-enoic acid, o-methyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.151809184 u |
| Formula | C13H22O4 |
| InChI | InChI=1S/C13H22O4/c1-11(13(15)17-3)9-7-5-4-6-8-10-12(14)16-2/h1,4-10H2,2-3H3 |
| InChIKey | ICOIIDMPNQDVKB-UHFFFAOYSA-N |
| Molecular Weight | 242.315 g/mol |
| SMILES | C(CCCCCCCC(=C)C(=O)OC)(=O)OC |