| SpectraBase Compound ID | 2AXAfTEEYBT |
|---|---|
| InChI | InChI=1S/C13H15NO/c1-13(2,15)8-7-10-9-14-12-6-4-3-5-11(10)12/h3-9,14-15H,1-2H3/b8-7+ |
| InChIKey | NJUFMKZHZYUCKJ-BQYQJAHWSA-N |
| Mol Weight | 201.27 g/mol |
| Molecular Formula | C13H15NO |
| Exact Mass | 201.115364 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HskFhTja7db |
|---|---|
| Name | (E)-.beta.-(3-Hydroxy-3-methylbutenyl)indole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.115364106 u |
| Formula | C13H15NO |
| InChI | InChI=1S/C13H15NO/c1-13(2,15)8-7-10-9-14-12-6-4-3-5-11(10)12/h3-9,14-15H,1-2H3/b8-7+ |
| InChIKey | NJUFMKZHZYUCKJ-BQYQJAHWSA-N |
| Molecular Weight | 201.269 g/mol |
| SMILES | C=1NC2=C(C1\C=C\C(O)(C)C)C=CC=C2 |