![Bis[7-cyano-1,3,5-cycloheptatriene]](/api/spectrum/rE88fYqQBW/structure.png?h=300&w=458 "Bis[7-cyano-1,3,5-cycloheptatriene]")
| SpectraBase Compound ID | LtSxNouNGvV |
|---|---|
| InChI | InChI=1S/C16H12N2/c17-11-13-7-3-1-5-9-15(13)16-10-6-2-4-8-14(16)12-18/h1-10,13-14H |
| InChIKey | YTJYZIDGFBKIAE-UHFFFAOYSA-N |
| Mol Weight | 232.29 g/mol |
| Molecular Formula | C16H12N2 |
| Exact Mass | 232.100048 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | rE88fYqQBW |
|---|---|
| Name | Bis[7-cyano-1,3,5-cycloheptatriene] |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H12N2 |
| InChI | InChI=1S/C16H12N2/c17-11-13-7-3-1-5-9-15(13)16-10-6-2-4-8-14(16)12-18/h1-10,13-14H |
| InChIKey | YTJYZIDGFBKIAE-UHFFFAOYSA-N |
| Molecular Weight | 232.286 g/mol |
| SMILES | C=1(C=2C(C#N)C=CC=CC2)C(C#N)C=CC=CC1 |
| SPLASH | splash10-014i-0900000000-ce2ad60141decd67d281 |
| Source of Spectrum | E1-41-2189-23 |
| Wiley ID | 1552316 |