| SpectraBase Compound ID | AlitQLfLgfX |
|---|---|
| InChI | InChI=1S/C10H12O/c1-3-10(11)9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3 |
| InChIKey | QHVNQIJBHWOZRJ-UHFFFAOYSA-N |
| Mol Weight | 148.2 g/mol |
| Molecular Formula | C10H12O |
| Exact Mass | 148.088815 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | DRsQn8AxBQ2 |
|---|---|
| Name | 3'-Methylpropiophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.088815005 u |
| Formula | C10H12O |
| InChI | InChI=1S/C10H12O/c1-3-10(11)9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3 |
| InChIKey | QHVNQIJBHWOZRJ-UHFFFAOYSA-N |
| Molecular Weight | 148.205 g/mol |
| SMILES | C=1C(=CC(=CC1)C)C(CC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.895151 |