| SpectraBase Compound ID | 3MHo3OTt0uY |
|---|---|
| InChI | InChI=1S/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14) |
| InChIKey | SHKWSBAVRQZYLE-UHFFFAOYSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | BKWQxBopeFd |
|---|---|
| Name | 5-Oxo-5-phenylvaleric acid |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | B12687 |
| CAS Registry Number | 1501-05-9 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12O3 |
| InChI | 1S/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14) |
| InChIKey | SHKWSBAVRQZYLE-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 96% |
| Solvent | CDCl3 & DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | 4-Benzoylbutyric acid |
| Wiley ID | SIAL_13CNMR_010814 |