| SpectraBase Compound ID | 8B2tpqFwneB |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-5-6-7-8-9-14-17(20)22-15-12-10-11-13-16(15)23-18(21)19(2,3)4/h10-13H,5-9,14H2,1-4H3 |
| InChIKey | CYOFOMRWAASGMX-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 | 7FDZJJE65u0 |
|---|---|
| Name | 1,2-Benzenediol, o-octanoyl-o'-pivaloyl- |
| 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/c1-5-6-7-8-9-14-17(20)22-15-12-10-11-13-16(15)23-18(21)19(2,3)4/h10-13H,5-9,14H2,1-4H3 |
| InChIKey | CYOFOMRWAASGMX-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C1(=CC=CC=C1OC(CCCCCCC)=O)OC(C(C)(C)C)=O |