| SpectraBase Compound ID | 5pMq44SmtRE |
|---|---|
| InChI | InChI=1S/C13H16O3/c1-15-13(14)9-11-7-8-12(16-11)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3/t11-,12+/m1/s1 |
| InChIKey | DRBNQLFLJORWIJ-NEPJUHHUSA-N |
| Mol Weight | 220.27 g/mol |
| Molecular Formula | C13H16O3 |
| Exact Mass | 220.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 62TDEW637kG |
|---|---|
| Name | cis-Methyl (5-phenyltetrahydrofuran-2-yl)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.109944372 u |
| Formula | C13H16O3 |
| InChI | InChI=1S/C13H16O3/c1-15-13(14)9-11-7-8-12(16-11)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3/t11-,12+/m1/s1 |
| InChIKey | DRBNQLFLJORWIJ-NEPJUHHUSA-N |
| Molecular Weight | 220.268 g/mol |
| SMILES | [C@]1(O[C@](CC1)(CC(=O)OC)[H])(C=1C=CC=CC1)[H] |