| SpectraBase Compound ID | 8kXPyoNyTzD |
|---|---|
| InChI | InChI=1S/C8H11NO2/c1-5-4-9-6(2)7(5)8(10)11-3/h4,9H,1-3H3 |
| InChIKey | WTRAMBVKRHNQQU-UHFFFAOYSA-N |
| Mol Weight | 153.18 g/mol |
| Molecular Formula | C8H11NO2 |
| Exact Mass | 153.078979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LEXpSVkXwa |
|---|---|
| Name | 1H-Pyrrole-3-carboxylic acid, 2,4-dimethyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 153.078978596 u |
| Formula | C8H11NO2 |
| InChI | InChI=1S/C8H11NO2/c1-5-4-9-6(2)7(5)8(10)11-3/h4,9H,1-3H3 |
| InChIKey | WTRAMBVKRHNQQU-UHFFFAOYSA-N |
| Molecular Weight | 153.181 g/mol |
| SMILES | C(OC)(=O)C=1C(C)=CNC1C |