| SpectraBase Compound ID | 8spHxCgtLLc |
|---|---|
| InChI | InChI=1S/C14H15NO2/c1-10(15-11-6-3-2-4-7-11)14-12(16)8-5-9-13(14)17/h2-4,6-7,15H,5,8-9H2,1H3 |
| InChIKey | BBCGPSONMMWQCU-UHFFFAOYSA-N |
| Mol Weight | 229.28 g/mol |
| Molecular Formula | C14H15NO2 |
| Exact Mass | 229.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DTMCEz8wWGc |
|---|---|
| Name | 2-(1-Anilinoethylidene)-1,3-cyclohexanedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.110278725 u |
| Formula | C14H15NO2 |
| InChI | InChI=1S/C14H15NO2/c1-10(15-11-6-3-2-4-7-11)14-12(16)8-5-9-13(14)17/h2-4,6-7,15H,5,8-9H2,1H3 |
| InChIKey | BBCGPSONMMWQCU-UHFFFAOYSA-N |
| Molecular Weight | 229.279 g/mol |
| SMILES | C1(NC(=C2C(=O)CCCC2=O)C)=CC=CC=C1 |