| SpectraBase Compound ID | GQM4R6Kyk9g |
|---|---|
| InChI | InChI=1S/C11H17NO2/c1-3-5-6-9-7-8-10(12-9)11(13)14-4-2/h7-8,12H,3-6H2,1-2H3 |
| InChIKey | YLJSVCVAOZAOKQ-UHFFFAOYSA-N |
| Mol Weight | 195.26 g/mol |
| Molecular Formula | C11H17NO2 |
| Exact Mass | 195.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Ii47DEnE63 |
|---|---|
| Name | Ethyl 5-butyl-1H-pyrrole-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.125928789 u |
| Formula | C11H17NO2 |
| InChI | InChI=1S/C11H17NO2/c1-3-5-6-9-7-8-10(12-9)11(13)14-4-2/h7-8,12H,3-6H2,1-2H3 |
| InChIKey | YLJSVCVAOZAOKQ-UHFFFAOYSA-N |
| Molecular Weight | 195.262 g/mol |
| SMILES | C1(=CC=C(N1)CCCC)C(OCC)=O |