| SpectraBase Compound ID | CBcjAext5e9 |
|---|---|
| InChI | InChI=1S/C20H22/c1-17(2)13-15-20(19-11-7-4-8-12-19)16-14-18-9-5-3-6-10-18/h3-17,20H,1-2H3/b15-13+,16-14+ |
| InChIKey | WGDDNFOMTWGDRQ-WXUKJITCSA-N |
| Mol Weight | 262.4 g/mol |
| Molecular Formula | C20H22 |
| Exact Mass | 262.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2V1yY6eXHyL |
|---|---|
| Name | ((1E,4E)-6-Methylhepta-1,4-diene-1,3-diyl)dibenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.172150708 u |
| Formula | C20H22 |
| InChI | InChI=1S/C20H22/c1-17(2)13-15-20(19-11-7-4-8-12-19)16-14-18-9-5-3-6-10-18/h3-17,20H,1-2H3/b15-13+,16-14+ |
| InChIKey | WGDDNFOMTWGDRQ-WXUKJITCSA-N |
| Molecular Weight | 262.396 g/mol |
| SMILES | C(C)(\C=C\C(C=1C=CC=CC1)\C=C\C1=CC=CC=C1)C |