| SpectraBase Compound ID | DKmQ1oQYHgu |
|---|---|
| InChI | InChI=1S/C16H18/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16/h1-7,9-11,13,16H,8,12,14H2/b13-7+ |
| InChIKey | MZAWZGUKXFHDEN-NTUHNPAUSA-N |
| Mol Weight | 210.32 g/mol |
| Molecular Formula | C16H18 |
| Exact Mass | 210.140851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C3Yxa7sXUon |
|---|---|
| Name | 5-(4-Phenyl-trans-3-butenyl)cyclohexa-1,3-diene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.140850580 u |
| Formula | C16H18 |
| InChI | InChI=1S/C16H18/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16/h1-7,9-11,13,16H,8,12,14H2/b13-7+ |
| InChIKey | MZAWZGUKXFHDEN-NTUHNPAUSA-N |
| Molecular Weight | 210.320 g/mol |
| SMILES | C=1C=CCC(C1)CC\C=C\C=1C=CC=CC1 |