| SpectraBase Compound ID | JMmjUqcQgxg |
|---|---|
| InChI | InChI=1S/C17H17N/c1-13-15(12-11-14-7-3-2-4-8-14)16-9-5-6-10-17(16)18-13/h2-10,18H,11-12H2,1H3 |
| InChIKey | CGUZNYYNJKHRMF-UHFFFAOYSA-N |
| Mol Weight | 235.33 g/mol |
| Molecular Formula | C17H17N |
| Exact Mass | 235.1361 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J0Nx8yU7Vsg |
|---|---|
| Name | 3-(2-Phenethyl)-2-methylindole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.136099551 u |
| Formula | C17H17N |
| InChI | InChI=1S/C17H17N/c1-13-15(12-11-14-7-3-2-4-8-14)16-9-5-6-10-17(16)18-13/h2-10,18H,11-12H2,1H3 |
| InChIKey | CGUZNYYNJKHRMF-UHFFFAOYSA-N |
| Molecular Weight | 235.330 g/mol |
| SMILES | C=12C(NC(=C2CCC2=CC=CC=C2)C)=CC=CC1 |