| SpectraBase Compound ID | 6W9UX85hkpv |
|---|---|
| InChI | InChI=1S/C12H13N/c1-9(2)11-8-13(3)12-7-5-4-6-10(11)12/h4-8H,1H2,2-3H3 |
| InChIKey | MLFDOUVJKLBMBG-UHFFFAOYSA-N |
| Mol Weight | 171.24 g/mol |
| Molecular Formula | C12H13N |
| Exact Mass | 171.104799 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2oAOsGiMAMn |
|---|---|
| Name | 1-Methyl-3-(1-methylethenyl)indole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.104799423 u |
| Formula | C12H13N |
| InChI | InChI=1S/C12H13N/c1-9(2)11-8-13(3)12-7-5-4-6-10(11)12/h4-8H,1H2,2-3H3 |
| InChIKey | MLFDOUVJKLBMBG-UHFFFAOYSA-N |
| Molecular Weight | 171.243 g/mol |
| SMILES | C1(=CN(C)C2=C1C=CC=C2)C(=C)C |