![[6]-Paradol acetate](/api/spectrum/JCqLlwtU8tt/structure.png?h=300&w=458 "[6]-Paradol acetate")
| SpectraBase Compound ID | HcnaBqdooUU |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-4-5-6-7-8-9-17(21)12-10-16-11-13-18(23-15(2)20)19(14-16)22-3/h11,13-14H,4-10,12H2,1-3H3 |
| InChIKey | DNASPYVJWXABET-UHFFFAOYSA-N |
| Mol Weight | 320.43 g/mol |
| Molecular Formula | C19H28O4 |
| Exact Mass | 320.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JCqLlwtU8tt |
|---|---|
| Name | [6]-Paradol acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.198759378 u |
| Formula | C19H28O4 |
| InChI | InChI=1S/C19H28O4/c1-4-5-6-7-8-9-17(21)12-10-16-11-13-18(23-15(2)20)19(14-16)22-3/h11,13-14H,4-10,12H2,1-3H3 |
| InChIKey | DNASPYVJWXABET-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C(CC(CCCCCCC)=O)C1=CC(=C(C=C1)OC(C)=O)OC |