![(-)-4-[ (5R)-5-hydroxy-7-(4-methoxyphenyl)heptyl]phenol](/api/spectrum/5RvjhJfMSXC/structure.png?h=300&w=458 "(-)-4-[ (5R)-5-hydroxy-7-(4-methoxyphenyl)heptyl]phenol")
| SpectraBase Compound ID | HtHhd5YJqkJ |
|---|---|
| InChI | InChI=1S/C20H26O3/c1-23-20-14-9-17(10-15-20)8-11-18(21)5-3-2-4-16-6-12-19(22)13-7-16/h6-7,9-10,12-15,18,21-22H,2-5,8,11H2,1H3/t18-/m1/s1 |
| InChIKey | FBLPXSGNVIZXIX-GOSISDBHSA-N |
| Mol Weight | 314.43 g/mol |
| Molecular Formula | C20H26O3 |
| Exact Mass | 314.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5RvjhJfMSXC |
|---|---|
| Name | (-)-4-[ (5R)-5-hydroxy-7-(4-methoxyphenyl)heptyl]phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.188194694 u |
| Formula | C20H26O3 |
| InChI | InChI=1S/C20H26O3/c1-23-20-14-9-17(10-15-20)8-11-18(21)5-3-2-4-16-6-12-19(22)13-7-16/h6-7,9-10,12-15,18,21-22H,2-5,8,11H2,1H3/t18-/m1/s1 |
| InChIKey | FBLPXSGNVIZXIX-GOSISDBHSA-N |
| SMILES | C(C1=CC=C(OC)C=C1)C[C@@](CCCCC1=CC=C(C=C1)O)(O)[H] |