| SpectraBase Compound ID | FeGVaRSjCxT |
|---|---|
| InChI | InChI=1S/C15H10N2/c16-10-11-1-3-12(4-2-11)13-5-6-15-14(9-13)7-8-17-15/h1-9,17H |
| InChIKey | POHRJJCEWJUVEY-UHFFFAOYSA-N |
| Mol Weight | 218.26 g/mol |
| Molecular Formula | C15H10N2 |
| Exact Mass | 218.084398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2LXdge8ec8J |
|---|---|
| Name | 4-(1H-Indol-5-yl)-benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.084398330 u |
| Formula | C15H10N2 |
| InChI | InChI=1S/C15H10N2/c16-10-11-1-3-12(4-2-11)13-5-6-15-14(9-13)7-8-17-15/h1-9,17H |
| InChIKey | POHRJJCEWJUVEY-UHFFFAOYSA-N |
| Molecular Weight | 218.259 g/mol |
| SMILES | C=1(C=C2C=CNC2=CC1)C1=CC=C(C=C1)C#N |