| SpectraBase Compound ID | 7SJO0ejkGTL |
|---|---|
| InChI | InChI=1S/C10H10O3/c1-2-8-6-4-3-5-7(11)9(6)10(12)13-8/h3-5,8,11H,2H2,1H3 |
| InChIKey | MHENVRWNXCCIFX-UHFFFAOYSA-N |
| Mol Weight | 178.19 g/mol |
| Molecular Formula | C10H10O3 |
| Exact Mass | 178.062994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNxt8vk3avc |
|---|---|
| Name | 3-Ethyl-7-hydroxyphthalide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.062994179 u |
| Formula | C10H10O3 |
| InChI | InChI=1S/C10H10O3/c1-2-8-6-4-3-5-7(11)9(6)10(12)13-8/h3-5,8,11H,2H2,1H3 |
| InChIKey | MHENVRWNXCCIFX-UHFFFAOYSA-N |
| Molecular Weight | 178.187 g/mol |
| SMILES | C12=C(C(=CC=C2)O)C(=O)OC1CC |