| SpectraBase Compound ID | 1JnCGLfNMBD |
|---|---|
| InChI | InChI=1S/C19H18N2O/c1-14-10-17(12-15-2-6-20-7-3-15)19(22)18(11-14)13-16-4-8-21-9-5-16/h2-9,12-14H,10-11H2,1H3/b17-12+,18-13+ |
| InChIKey | VUTXFBWRJVXOIR-PWDIZTEBSA-N |
| Mol Weight | 290.37 g/mol |
| Molecular Formula | C19H18N2O |
| Exact Mass | 290.141913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | gT93WYKCCd |
|---|---|
| Name | Cyclohexanone, 4-methyl-2,6-bis(4-pyridinylmethylene)-, (2E,6E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.141913207 u |
| Formula | C19H18N2O |
| InChI | InChI=1S/C19H18N2O/c1-14-10-17(12-15-2-6-20-7-3-15)19(22)18(11-14)13-16-4-8-21-9-5-16/h2-9,12-14H,10-11H2,1H3/b17-12+,18-13+ |
| InChIKey | VUTXFBWRJVXOIR-PWDIZTEBSA-N |
| SMILES | C1(\C(CC(C\C1=C\C=1C=CN=CC1)C)=C\C=1C=CN=CC1)=O |