| SpectraBase Compound ID | 94S5yXJ5RlU |
|---|---|
| InChI | InChI=1S/C13H16O3/c1-2-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15/h2,6-9H,1,3-5,10H2,(H,14,15) |
| InChIKey | IBSMHZIMQAHZSK-UHFFFAOYSA-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 | HCj70VJRKkJ |
|---|---|
| Name | 4-(hex-5-en-1-Yloxy)benzoic acid |
| 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/c1-2-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15/h2,6-9H,1,3-5,10H2,(H,14,15) |
| InChIKey | IBSMHZIMQAHZSK-UHFFFAOYSA-N |
| Molecular Weight | 220.268 g/mol |
| SMILES | C(O)(=O)C1=CC=C(OCCCCC=C)C=C1 |