| SpectraBase Spectrum ID |
E2l5yPkhmDf |
| Name |
1H-Pyrrole-3-propanoic acid, 5-(ethoxycarbonyl)-, ethyl ester |
| Alternate Name(s) |
Pyrrole-3-propionic acid, 5-carboxy-, diethyl ester
Ethyl 2-ethoxycarbonyl-4-pyrrolepropionate
ethyl 4-(3-ethoxy-3-oxopropyl)-1H-pyrrole-2-carboxylate |
| CAS Registry Number |
91645-71-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17NO4 |
| InChI |
InChI=1S/C12H17NO4/c1-3-16-11(14)6-5-9-7-10(13-8-9)12(15)17-4-2/h7-8,13H,3-6H2,1-2H3 |
| InChIKey |
GFQALJRKCBETCN-UHFFFAOYSA-N |
| Molecular Weight |
239.271 g/mol |
| SMILES |
[nH]1cc(cc1C(=O)OCC)CCC(=O)OCC |
| SPLASH |
splash10-0udr-0980000000-65a9cbe55ec700b37c58 |
| Source of Spectrum |
F-45-6648-14 |
| Wiley ID |
1241829 |
