| SpectraBase Compound ID | wrdh9xMAr0 |
|---|---|
| InChI | InChI=1S/C11H10O2/c1-2-3-9-11(12)13-10-7-5-4-6-8-10/h2-9H,1H2/b9-3+ |
| InChIKey | GXRKNVDQYVIVME-YCRREMRBSA-N |
| Mol Weight | 174.2 g/mol |
| Molecular Formula | C11H10O2 |
| Exact Mass | 174.06808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FU6POPpjbFF |
|---|---|
| Name | (2E)-Penta-2,4-dienoic acid phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.068079560 u |
| Formula | C11H10O2 |
| InChI | InChI=1S/C11H10O2/c1-2-3-9-11(12)13-10-7-5-4-6-8-10/h2-9H,1H2/b9-3+ |
| InChIKey | GXRKNVDQYVIVME-YCRREMRBSA-N |
| Molecular Weight | 174.199 g/mol |
| SMILES | C(\C=C\C=C)(=O)OC=1C=CC=CC1 |