| SpectraBase Compound ID | 92rhKlQTD2D |
|---|---|
| InChI | InChI=1S/C11H14O4/c1-14-11(13)7-3-2-5-9(12)10-6-4-8-15-10/h4,6,8H,2-3,5,7H2,1H3 |
| InChIKey | LVVJBGKSQGHHRO-UHFFFAOYSA-N |
| Mol Weight | 210.23 g/mol |
| Molecular Formula | C11H14O4 |
| Exact Mass | 210.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6VYmkZ1ytRD |
|---|---|
| Name | Methyl 5-(2-furoyl)pentanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.089208927 u |
| Formula | C11H14O4 |
| InChI | InChI=1S/C11H14O4/c1-14-11(13)7-3-2-5-9(12)10-6-4-8-15-10/h4,6,8H,2-3,5,7H2,1H3 |
| InChIKey | LVVJBGKSQGHHRO-UHFFFAOYSA-N |
| Molecular Weight | 210.229 g/mol |
| SMILES | C(CCCCC(OC)=O)(=O)C=1OC=CC1 |