| SpectraBase Compound ID | 18BGHd9hVP4 |
|---|---|
| InChI | InChI=1S/C25H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-24(26)20-22(27-2)21-25(23)28-3/h20-21,26H,4-19H2,1-3H3 |
| InChIKey | PYBCPMWOGALBBN-UHFFFAOYSA-N |
| Mol Weight | 392.6 g/mol |
| Molecular Formula | C25H44O3 |
| Exact Mass | 392.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9S8PlaEAQRX |
|---|---|
| Name | 2-Heptadecyl-3,5-dimethoxy-phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.329045274 u |
| Formula | C25H44O3 |
| InChI | InChI=1S/C25H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-24(26)20-22(27-2)21-25(23)28-3/h20-21,26H,4-19H2,1-3H3 |
| InChIKey | PYBCPMWOGALBBN-UHFFFAOYSA-N |
| Molecular Weight | 392.624 g/mol |
| SMILES | C=1(C=C(C=C(C1CCCCCCCCCCCCCCCCC)OC)OC)O |