| SpectraBase Compound ID | 8ajDAbzqzjV |
|---|---|
| InChI | InChI=1S/C16H16/c1-14-8-5-6-12-16(14)13-7-11-15-9-3-2-4-10-15/h2-12H,13H2,1H3/b11-7+ |
| InChIKey | FJDOKAPXPSAEQA-YRNVUSSQSA-N |
| Mol Weight | 208.3 g/mol |
| Molecular Formula | C16H16 |
| Exact Mass | 208.125201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7QSJ3kRjRU6 |
|---|---|
| Name | (E)-3-(2-Methylphenyl)-1-phenylpropene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.125200515 u |
| Formula | C16H16 |
| InChI | InChI=1S/C16H16/c1-14-8-5-6-12-16(14)13-7-11-15-9-3-2-4-10-15/h2-12H,13H2,1H3/b11-7+ |
| InChIKey | FJDOKAPXPSAEQA-YRNVUSSQSA-N |
| Molecular Weight | 208.304 g/mol |
| SMILES | C=1C=C(C=CC1)\C=C\CC1=C(C=CC=C1)C |