| SpectraBase Compound ID | F9ZqvHsiTu6 |
|---|---|
| InChI | InChI=1S/C9H10/c1-3-9-6-4-8(2)5-7-9/h3-7H,1H2,2H3 |
| InChIKey | JLBJTVDPSNHSKJ-UHFFFAOYSA-N |
| Mol Weight | 118.18 g/mol |
| Molecular Formula | C9H10 |
| Exact Mass | 118.07825 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3UUp9XR5mPl |
|---|---|
| Name | Vinyl toluene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 118.078250322 u |
| Formula | C9H10 |
| InChI | InChI=1S/C9H10/c1-3-9-6-4-8(2)5-7-9/h3-7H,1H2,2H3 |
| InChIKey | JLBJTVDPSNHSKJ-UHFFFAOYSA-N |
| Molecular Weight | 118.179 g/mol |
| SMILES | C=1C(=CC=C(C1)C)C=C |
| Spectrum/Structure Validation Score (Raman) | 0.976772 |