| SpectraBase Compound ID | 8EcOykatpgM |
|---|---|
| InChI | InChI=1S/C12H13NO2/c1-2-8-3-4-11-10(5-8)9(7-13-11)6-12(14)15/h3-5,7,13H,2,6H2,1H3,(H,14,15) |
| InChIKey | ZWXOHBRBIAQHFP-UHFFFAOYSA-N |
| Mol Weight | 203.24 g/mol |
| Molecular Formula | C12H13NO2 |
| Exact Mass | 203.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hdq1O2N1mYv |
|---|---|
| Name | 5-Ethylindole-3-acetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 203.094628661 u |
| Formula | C12H13NO2 |
| InChI | InChI=1S/C12H13NO2/c1-2-8-3-4-11-10(5-8)9(7-13-11)6-12(14)15/h3-5,7,13H,2,6H2,1H3,(H,14,15) |
| InChIKey | ZWXOHBRBIAQHFP-UHFFFAOYSA-N |
| Molecular Weight | 203.241 g/mol |
| SMILES | N1C=2C=CC(=CC2C(CC(=O)O)=C1)CC |