| SpectraBase Spectrum ID |
2QHuE7hrbR |
| Name |
1H-Pyrrole-3-butanoic acid, 2-(methoxycarbonyl)-4-methyl-, methyl ester |
| Alternate Name(s) |
Methyl 3-(3-methoxycarbonylpropyl)-4-methylpyrrole-2-carboxylate
Methyl 3-(4-methoxy-4-oxobutyl)-4-methyl-1H-pyrrole-2-carboxylate |
| CAS Registry Number |
99602-63-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17NO4 |
| InChI |
InChI=1S/C12H17NO4/c1-8-7-13-11(12(15)17-3)9(8)5-4-6-10(14)16-2/h7,13H,4-6H2,1-3H3 |
| InChIKey |
PBDILGNHNNGWQX-UHFFFAOYSA-N |
| Molecular Weight |
239.271 g/mol |
| SMILES |
[nH]1cc(c(c1C(=O)OC)CCCC(=O)OC)C |
| SPLASH |
splash10-00y0-0950000000-62886fe4878f140377d9 |
| Source of Spectrum |
KC-1985-1704-0 |
| Wiley ID |
1241840 |
