| SpectraBase Compound ID | 2NtX44KTEpQ |
|---|---|
| InChI | InChI=1S/C16H15N/c1-13-7-8-16-15(11-13)9-10-17(16)12-14-5-3-2-4-6-14/h2-11H,12H2,1H3 |
| InChIKey | UAXORUSBKLNRMJ-UHFFFAOYSA-N |
| Mol Weight | 221.3 g/mol |
| Molecular Formula | C16H15N |
| Exact Mass | 221.120449 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | XsYQruBNpD |
|---|---|
| Name | 1-Benzyl-5-methylindole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.120449487 u |
| Formula | C16H15N |
| InChI | InChI=1S/C16H15N/c1-13-7-8-16-15(11-13)9-10-17(16)12-14-5-3-2-4-6-14/h2-11H,12H2,1H3 |
| InChIKey | UAXORUSBKLNRMJ-UHFFFAOYSA-N |
| Molecular Weight | 221.303 g/mol |
| SMILES | C1=2N(CC=3C=CC=CC3)C=CC1=CC(=CC2)C |