| SpectraBase Compound ID | GhG2cQqOrOp |
|---|---|
| InChI | InChI=1S/C12H17NO4/c1-5-16-11(14)9-7(3)10(13-8(9)4)12(15)17-6-2/h13H,5-6H2,1-4H3 |
| InChIKey | XSBSXJAYEPDGSF-UHFFFAOYSA-N |
| Mol Weight | 239.27 g/mol |
| Molecular Formula | C12H17NO4 |
| Exact Mass | 239.115758 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LoNFl2C2HWU |
|---|---|
| Name | 1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, diethyl ester |
| CAS Registry Number | 2436-79-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H17NO4 |
| InChI | InChI=1S/C12H17NO4/c1-5-16-11(14)9-7(3)10(13-8(9)4)12(15)17-6-2/h13H,5-6H2,1-4H3 |
| InChIKey | XSBSXJAYEPDGSF-UHFFFAOYSA-N |
| Molecular Weight | 239.271 g/mol |
| SMILES | [nH]1c(c(c(c1C)C(=O)OCC)C)C(=O)OCC |
| SPLASH | splash10-0005-0920000000-7d22e4c9eb2933ba8ddc |
| Source of Spectrum | Y-28-1689-5 |
| Synonyms | 2,4-Dimethyl-3,5-dicarbethoxypyrrole 2,4-Dimethyl-3,5-diethoxycarbonyl-pyrrole Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate 3,5-Dimethyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate Diethyl 3,5-dimethylpyrrole-2,4-dicarboxylate Knorr's pyrrole Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, diethyl ester Pyrrole-3,5-bis(carboxylic acid), 2,4-dimethyl-, diethyl ester AI3-19854 EINECS 219-431-2 |
| Wiley ID | 1241851 |