| SpectraBase Compound ID | Dd9wtms3tUU |
|---|---|
| InChI | InChI=1S/C14H18/c1-12(10-11-14(2,3)4)13-8-6-5-7-9-13/h5-9,11H,1-4H3 |
| InChIKey | CWTUCRCDZHTDSS-UHFFFAOYSA-N |
| Mol Weight | 186.3 g/mol |
| Molecular Formula | C14H18 |
| Exact Mass | 186.140851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EXQNu3nuYF3 |
|---|---|
| Name | 2-Phenyl-5,5-dimethyl-2,3-hexadiene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.140850580 u |
| Formula | C14H18 |
| InChI | InChI=1S/C14H18/c1-12(10-11-14(2,3)4)13-8-6-5-7-9-13/h5-9,11H,1-4H3 |
| InChIKey | CWTUCRCDZHTDSS-UHFFFAOYSA-N |
| Molecular Weight | 186.298 g/mol |
| SMILES | C(=C=CC(C)(C)C)(C=1C=CC=CC1)C |