| SpectraBase Compound ID | G2n7QSPGYGQ |
|---|---|
| InChI | InChI=1S/C13H16N2/c1-11(2)6-4-5-7-12(3)8-13(9-14)10-15/h6-8H,4-5H2,1-3H3/b12-7- |
| InChIKey | GGDOOVBGCCFAEI-GHXNOFRVSA-N |
| Mol Weight | 200.28 g/mol |
| Molecular Formula | C13H16N2 |
| Exact Mass | 200.131349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2EuKxwValgI |
|---|---|
| Name | 1,3,7-Nonatriene-1,1-dicarbonitrile, 4,8-dimethyl-, (Z)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.131348523 u |
| Formula | C13H16N2 |
| InChI | InChI=1S/C13H16N2/c1-11(2)6-4-5-7-12(3)8-13(9-14)10-15/h6-8H,4-5H2,1-3H3/b12-7- |
| InChIKey | GGDOOVBGCCFAEI-GHXNOFRVSA-N |
| Molecular Weight | 200.285 g/mol |
| SMILES | CC(=CCC\C=C/(C=C(C#N)C#N)C)C |