| SpectraBase Compound ID | I8UjhvH4SOl |
|---|---|
| InChI | InChI=1S/C16H8N2/c17-9-11-1-3-13-5-6-14-4-2-12(10-18)8-16(14)15(13)7-11/h1-8H |
| InChIKey | WVGPDBFDFCNBLH-UHFFFAOYSA-N |
| Mol Weight | 228.25 g/mol |
| Molecular Formula | C16H8N2 |
| Exact Mass | 228.068748 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1fwfKPNH4oD |
|---|---|
| Name | 3,6-Phenanthrenedicarbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.068748266 u |
| Formula | C16H8N2 |
| InChI | InChI=1S/C16H8N2/c17-9-11-1-3-13-5-6-14-4-2-12(10-18)8-16(14)15(13)7-11/h1-8H |
| InChIKey | WVGPDBFDFCNBLH-UHFFFAOYSA-N |
| Molecular Weight | 228.254 g/mol |
| SMILES | C(#N)C1=CC2=C3C(=CC=C2C=C1)C=CC(=C3)C#N |