| SpectraBase Compound ID | L4Gh5kdA6n3 |
|---|---|
| InChI | InChI=1S/C16H16/c1-14(16-10-6-3-7-11-16)12-13-15-8-4-2-5-9-15/h2-14H,1H3/b13-12+ |
| InChIKey | GNQWHYWLSGTMSL-OUKQBFOZSA-N |
| Mol Weight | 208.3 g/mol |
| Molecular Formula | C16H16 |
| Exact Mass | 208.125201 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IpcnL4jPZFB |
|---|---|
| Name | (E)-1,3-Diphenylbut-1-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.125200515 u |
| Formula | C16H16 |
| InChI | InChI=1S/C16H16/c1-14(16-10-6-3-7-11-16)12-13-15-8-4-2-5-9-15/h2-14H,1H3/b13-12+ |
| InChIKey | GNQWHYWLSGTMSL-OUKQBFOZSA-N |
| Molecular Weight | 208.304 g/mol |
| SMILES | C=1C(\C=C\C(C2=CC=CC=C2)C)=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.988447 |