| SpectraBase Compound ID | 1sNeRsbZvF4 |
|---|---|
| InChI | InChI=1S/C11H10N2/c1-13-8-9(6-7-12)10-4-2-3-5-11(10)13/h2-5,8H,6H2,1H3 |
| InChIKey | DHAXZZYQEUESTH-UHFFFAOYSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C11H10N2 |
| Exact Mass | 170.084398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kei9F8g6869 |
|---|---|
| Name | (1-Methyl-1H-indol-3-yl)acetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.084398330 u |
| Formula | C11H10N2 |
| InChI | InChI=1S/C11H10N2/c1-13-8-9(6-7-12)10-4-2-3-5-11(10)13/h2-5,8H,6H2,1H3 |
| InChIKey | DHAXZZYQEUESTH-UHFFFAOYSA-N |
| Molecular Weight | 170.215 g/mol |
| SMILES | C(CC1=CN(C2=C1C=CC=C2)C)#N |