| SpectraBase Compound ID | 6WcROBUY9CW |
|---|---|
| InChI | InChI=1S/C15H20O3/c1-3-11-17-14-8-5-13(6-9-14)7-10-15(16)18-12-4-2/h5-10H,3-4,11-12H2,1-2H3/b10-7+ |
| InChIKey | AIBIOVGEMZXLDT-JXMROGBWSA-N |
| Mol Weight | 248.32 g/mol |
| Molecular Formula | C15H20O3 |
| Exact Mass | 248.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Her0vFCGnt9 |
|---|---|
| Name | p-Coumaric acid, propyl ether, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.141244501 u |
| Formula | C15H20O3 |
| InChI | InChI=1S/C15H20O3/c1-3-11-17-14-8-5-13(6-9-14)7-10-15(16)18-12-4-2/h5-10H,3-4,11-12H2,1-2H3/b10-7+ |
| InChIKey | AIBIOVGEMZXLDT-JXMROGBWSA-N |
| Molecular Weight | 248.322 g/mol |
| SMILES | C1=CC(=CC=C1\C=C\C(=O)OCCC)OCCC |