| SpectraBase Compound ID | GvbUf5QGDdh |
|---|---|
| InChI | InChI=1S/C13H16O3/c1-15-12-8-4-5-10(9-12)13(14)16-11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7H2,1H3 |
| InChIKey | WUVHFFKCMXUFTP-UHFFFAOYSA-N |
| Mol Weight | 220.27 g/mol |
| Molecular Formula | C13H16O3 |
| Exact Mass | 220.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | By4j7ynD9lD |
|---|---|
| Name | 3-Methoxybenzoic acid, cyclopentyl ester |
| 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/c1-15-12-8-4-5-10(9-12)13(14)16-11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7H2,1H3 |
| InChIKey | WUVHFFKCMXUFTP-UHFFFAOYSA-N |
| Molecular Weight | 220.268 g/mol |
| SMILES | C1(CCCC1)OC(C=1C=CC=C(C1)OC)=O |