| SpectraBase Compound ID | 5TpdIQx169b |
|---|---|
| InChI | InChI=1S/C13H14O3/c1-16-13(15)10-9-12(14)8-7-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3/b8-7+ |
| InChIKey | NTMXDQDSCIDWGV-BQYQJAHWSA-N |
| Mol Weight | 218.25 g/mol |
| Molecular Formula | C13H14O3 |
| Exact Mass | 218.094294 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 9FlsZG3IRjf |
|---|---|
| Name | trans-4-OXO-6-PHENYL-5-HEXENOIC ACID, METHYL ESTER |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14O3 |
| InChI | InChI=1S/C13H14O3/c1-16-13(15)10-9-12(14)8-7-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3/b8-7+ |
| InChIKey | NTMXDQDSCIDWGV-BQYQJAHWSA-N |
| Instrument Name | BRUKER AC-300 |
| Molecular Weight | 218.25 |
| Solvent | CDCl3; Reference=TMS; Temperature 297K |