| SpectraBase Compound ID | BroOJ63bZZN |
|---|---|
| InChI | InChI=1S/C17H20O4/c1-10(2)14(18)9-12-8-13(16(19)20)7-11-5-6-17(3,4)21-15(11)12/h5-8,14,18H,1,9H2,2-4H3,(H,19,20) |
| InChIKey | ZJPNOGWBMZOBFI-UHFFFAOYSA-N |
| Mol Weight | 288.34 g/mol |
| Molecular Formula | C17H20O4 |
| Exact Mass | 288.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CushrAl2goi |
|---|---|
| Name | 8-(2-Hydroxy-3-methylbut-3-enyl)-2,2-dimethyl-2H-chromene-6-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.136159120 u |
| Formula | C17H20O4 |
| InChI | InChI=1S/C17H20O4/c1-10(2)14(18)9-12-8-13(16(19)20)7-11-5-6-17(3,4)21-15(11)12/h5-8,14,18H,1,9H2,2-4H3,(H,19,20) |
| InChIKey | ZJPNOGWBMZOBFI-UHFFFAOYSA-N |
| SMILES | C1=C(C=C(C2=C1C=CC(O2)(C)C)CC(C(=C)C)O)C(O)=O |