| SpectraBase Compound ID | Dt3qEDbAILf |
|---|---|
| InChI | InChI=1S/C15H12/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-6,8-13H |
| InChIKey | ZSSBYOXGEIGBLA-UHFFFAOYSA-N |
| Mol Weight | 192.26 g/mol |
| Molecular Formula | C15H12 |
| Exact Mass | 192.0939 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5ZD7fYj5Liy |
|---|---|
| Name | 3-Phenylpropa-1,2-dienylbenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.093900386 u |
| Formula | C15H12 |
| InChI | InChI=1S/C15H12/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-6,8-13H |
| InChIKey | ZSSBYOXGEIGBLA-UHFFFAOYSA-N |
| Molecular Weight | 192.261 g/mol |
| SMILES | C=1C(C=C=CC2=CC=CC=C2)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964401 |