| SpectraBase Compound ID | 9XN0l0yd1Ya |
|---|---|
| InChI | InChI=1S/C19H26O5/c1-2-23-18(21)9-7-5-3-4-6-8-10-19(22)24-17-13-11-16(15-20)12-14-17/h11-15H,2-10H2,1H3 |
| InChIKey | OYEXBUPZQSIIRG-UHFFFAOYSA-N |
| Mol Weight | 334.41 g/mol |
| Molecular Formula | C19H26O5 |
| Exact Mass | 334.178024 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GrmV1VGzBf4 |
|---|---|
| Name | Sebacic acid, ethyl 4-formylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.178023932 u |
| Formula | C19H26O5 |
| InChI | InChI=1S/C19H26O5/c1-2-23-18(21)9-7-5-3-4-6-8-10-19(22)24-17-13-11-16(15-20)12-14-17/h11-15H,2-10H2,1H3 |
| InChIKey | OYEXBUPZQSIIRG-UHFFFAOYSA-N |
| Molecular Weight | 334.412 g/mol |
| SMILES | C(CCCCCCC(OC1=CC=C(C=O)C=C1)=O)CC(OCC)=O |