| SpectraBase Spectrum ID |
3yuqe4JgnxX |
| Name |
5-Formyl-3-methyl-1-phenacyl-pyrrole-2,4-dicarboxylic acid diethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.136887394 u |
| Formula |
C20H21NO6 |
| InChI |
InChI=1S/C20H21NO6/c1-4-26-19(24)17-13(3)18(20(25)27-5-2)21(15(17)12-22)11-16(23)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3 |
| InChIKey |
ULDCIYIMBUHSJW-UHFFFAOYSA-N |
| Molecular Weight |
371.389 g/mol |
| SMILES |
C=1(N(C(=C(C1C(=O)OCC)C)C(=O)OCC)CC(=O)C=1C=CC=CC1)C=O |
