| SpectraBase Compound ID | E7RJBth1sSq |
|---|---|
| InChI | InChI=1S/C13H15NO2/c1-2-16-13(15)8-7-11-9-10-5-3-4-6-12(10)14-11/h3-6,9,14H,2,7-8H2,1H3 |
| InChIKey | HQSCSIPNMBYZEH-UHFFFAOYSA-N |
| Mol Weight | 217.27 g/mol |
| Molecular Formula | C13H15NO2 |
| Exact Mass | 217.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GGEm6ob86gW |
|---|---|
| Name | Ethyl 3-(1H-indol-2-yl)propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.110278725 u |
| Formula | C13H15NO2 |
| InChI | InChI=1S/C13H15NO2/c1-2-16-13(15)8-7-11-9-10-5-3-4-6-12(10)14-11/h3-6,9,14H,2,7-8H2,1H3 |
| InChIKey | HQSCSIPNMBYZEH-UHFFFAOYSA-N |
| Molecular Weight | 217.268 g/mol |
| SMILES | C=1C=C2C=C(NC2=CC1)CCC(=O)OCC |