| SpectraBase Compound ID | H0bNt4NnPrw |
|---|---|
| InChI | InChI=1S/C9H14O4/c1-3-12-9(10)7-5-4-6-8(11-2)13-7/h4,6-8H,3,5H2,1-2H3 |
| InChIKey | ZOTGPTQNWLHTNN-UHFFFAOYSA-N |
| Mol Weight | 186.21 g/mol |
| Molecular Formula | C9H14O4 |
| Exact Mass | 186.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ie3Tf2FlIbR |
|---|---|
| Name | 2H-Pyran-2-carboxylic acid, 3,6-dihydro-6-methoxy-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.089208927 u |
| Formula | C9H14O4 |
| InChI | InChI=1S/C9H14O4/c1-3-12-9(10)7-5-4-6-8(11-2)13-7/h4,6-8H,3,5H2,1-2H3 |
| InChIKey | ZOTGPTQNWLHTNN-UHFFFAOYSA-N |
| Molecular Weight | 186.207 g/mol |
| SMILES | C(OCC)(=O)C1OC(OC)C=CC1 |