| SpectraBase Compound ID | AFTJx9Hhhlm |
|---|---|
| InChI | InChI=1S/C16H14N4O2/c17-11-13-5-3-7-15(19-13)21-9-1-2-10-22-16-8-4-6-14(12-18)20-16/h3-8H,1-2,9-10H2 |
| InChIKey | DFVYYIMMWJKZKC-UHFFFAOYSA-N |
| Mol Weight | 294.31 g/mol |
| Molecular Formula | C16H14N4O2 |
| Exact Mass | 294.111676 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HNLW8WK96Lk |
|---|---|
| Name | 6,6'-(Tetramethylenedioxy)dipicolinonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.111675705 u |
| Formula | C16H14N4O2 |
| InChI | InChI=1S/C16H14N4O2/c17-11-13-5-3-7-15(19-13)21-9-1-2-10-22-16-8-4-6-14(12-18)20-16/h3-8H,1-2,9-10H2 |
| InChIKey | DFVYYIMMWJKZKC-UHFFFAOYSA-N |
| SMILES | C=1C(=NC(=CC1)OCCCCOC=1N=C(C=CC1)C#N)C#N |