| SpectraBase Compound ID | 7eePyQ0wH1u |
|---|---|
| InChI | InChI=1S/C14H16O4/c1-17-13(15)10-6-3-7-11-18-14(16)12-8-4-2-5-9-12/h2,4-6,8-10H,3,7,11H2,1H3/b10-6+ |
| InChIKey | UCVCATRBIZCAOA-UXBLZVDNSA-N |
| Mol Weight | 248.28 g/mol |
| Molecular Formula | C14H16O4 |
| Exact Mass | 248.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Fbpz8JJ2xn |
|---|---|
| Name | Methyl (E)-6-benzoyloxy-2-hexenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.104858991 u |
| Formula | C14H16O4 |
| InChI | InChI=1S/C14H16O4/c1-17-13(15)10-6-3-7-11-18-14(16)12-8-4-2-5-9-12/h2,4-6,8-10H,3,7,11H2,1H3/b10-6+ |
| InChIKey | UCVCATRBIZCAOA-UXBLZVDNSA-N |
| Molecular Weight | 248.278 g/mol |
| SMILES | C(=O)(C1=CC=CC=C1)OCCC\C=C\C(=O)OC |