| SpectraBase Compound ID | BCqOwMrcTLc |
|---|---|
| InChI | InChI=1S/C11H8O3/c1-7(12)9-6-8-4-2-3-5-10(8)14-11(9)13/h2-6H,1H3 |
| InChIKey | CSPIFKKOBWYOEX-UHFFFAOYSA-N |
| Mol Weight | 188.18 g/mol |
| Molecular Formula | C11H8O3 |
| Exact Mass | 188.047344 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 5HbXXh7HsMp |
|---|---|
| Name | 3-Acetylcoumarin |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 214671 |
| CAS Registry Number | 3949-36-8 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H8O3 |
| InChI | InChI=1S/C11H8O3/c1-7(12)9-6-8-4-2-3-5-10(8)14-11(9)13/h2-6H,1H3 |
| InChIKey | CSPIFKKOBWYOEX-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 96% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_003073 |