| SpectraBase Spectrum ID |
6ZYhqitsB3D |
| Name |
4-(2-Carboxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17NO4 |
| InChI |
InChI=1S/C12H17NO4/c1-4-17-12(16)11-7(2)9(8(3)13-11)5-6-10(14)15/h13H,4-6H2,1-3H3,(H,14,15) |
| InChIKey |
CUMYMXCUGHBKLV-UHFFFAOYSA-N |
| Molecular Weight |
239.271 g/mol |
| SMILES |
[nH]1c(c(CCC(=O)O)c(c1C(=O)OCC)C)C |
| SPLASH |
splash10-001i-0910000000-712d177369e633261680 |
| Source of Spectrum |
F-53-2712-28 |
| Synonyms |
3,5-Dimethyl-2-(ethoxycarbonyl)-1H-pyrrole-3-propanoic acid
3-(5-Ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoic acid
3-(5-carbethoxy-2,4-dimethyl-1H-pyrrol-3-yl)propionic acid
3-[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid |
| Wiley ID |
800673 |
