| SpectraBase Compound ID | 4iJddLjFS4w |
|---|---|
| InChI | InChI=1S/C17H26O4/c1-19-15-12-11-14(13-16(15)20-2)9-7-5-4-6-8-10-17(18)21-3/h11-13H,4-10H2,1-3H3 |
| InChIKey | CUIKGUWVUPNWNR-UHFFFAOYSA-N |
| Mol Weight | 294.39 g/mol |
| Molecular Formula | C17H26O4 |
| Exact Mass | 294.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1EwIhchNlE6 |
|---|---|
| Name | Benzeneoctanoic acid, 3,4-dimethoxy-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.183109313 u |
| Formula | C17H26O4 |
| InChI | InChI=1S/C17H26O4/c1-19-15-12-11-14(13-16(15)20-2)9-7-5-4-6-8-10-17(18)21-3/h11-13H,4-10H2,1-3H3 |
| InChIKey | CUIKGUWVUPNWNR-UHFFFAOYSA-N |
| SMILES | C=1(C(=CC=C(C1)CCCCCCCC(=O)OC)OC)OC |