| SpectraBase Compound ID | hAaT8o6CAs |
|---|---|
| InChI | InChI=1S/C12H14N2O2/c13-8-2-6-12(7-3-9-14)10(15)4-1-5-11(12)16/h1-7H2 |
| InChIKey | CHXMOZAAYVFVNJ-UHFFFAOYSA-N |
| Mol Weight | 218.26 g/mol |
| Molecular Formula | C12H14N2O2 |
| Exact Mass | 218.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2lryqxVukEr |
|---|---|
| Name | 3,3'-(2,6-Dioxocyclohexylidene)dipropionitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.105527697 u |
| Formula | C12H14N2O2 |
| InChI | InChI=1S/C12H14N2O2/c13-8-2-6-12(7-3-9-14)10(15)4-1-5-11(12)16/h1-7H2 |
| InChIKey | CHXMOZAAYVFVNJ-UHFFFAOYSA-N |
| Molecular Weight | 218.256 g/mol |
| SMILES | C1(CCC#N)(CCC#N)C(CCCC1=O)=O |