| SpectraBase Compound ID | 8Q67AEggSo4 |
|---|---|
| InChI | InChI=1S/C13H13NO3/c1-8-9(2)13(16)14(12(8)15)10-4-6-11(17-3)7-5-10/h4-7H,1-3H3 |
| InChIKey | SGEUERYREATRRO-UHFFFAOYSA-N |
| Mol Weight | 231.25 g/mol |
| Molecular Formula | C13H13NO3 |
| Exact Mass | 231.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ei0GXr2eNRB |
|---|---|
| Name | 1H-Pyrrole-2,5-dione, 1-(4-methoxyphenyl)-3,4-dimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.089543280 u |
| Formula | C13H13NO3 |
| InChI | InChI=1S/C13H13NO3/c1-8-9(2)13(16)14(12(8)15)10-4-6-11(17-3)7-5-10/h4-7H,1-3H3 |
| InChIKey | SGEUERYREATRRO-UHFFFAOYSA-N |
| Molecular Weight | 231.251 g/mol |
| SMILES | C1=CC(=CC=C1N1C(C(=C(C1=O)C)C)=O)OC |