| SpectraBase Compound ID | LO0SwNDBcAD |
|---|---|
| InChI | InChI=1S/C11H16O3/c1-9(2)5-3-8-14-11(12)10-6-4-7-13-10/h4,6-7,9H,3,5,8H2,1-2H3 |
| InChIKey | OPKYCBLKTDUYLH-UHFFFAOYSA-N |
| Mol Weight | 196.25 g/mol |
| Molecular Formula | C11H16O3 |
| Exact Mass | 196.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4vTcII9A2Lv |
|---|---|
| Name | 2-Furancarboxylic acid, 4-methylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.109944372 u |
| Formula | C11H16O3 |
| InChI | InChI=1S/C11H16O3/c1-9(2)5-3-8-14-11(12)10-6-4-7-13-10/h4,6-7,9H,3,5,8H2,1-2H3 |
| InChIKey | OPKYCBLKTDUYLH-UHFFFAOYSA-N |
| Molecular Weight | 196.246 g/mol |
| SMILES | CC(C)CCCOC(=O)C=1OC=CC1 |