| SpectraBase Compound ID | 5Ilk07g2CJy |
|---|---|
| InChI | InChI=1S/C10H12O/c1-7-4-8(2)10(6-11)9(3)5-7/h4-6H,1-3H3 |
| InChIKey | HIKRJHFHGKZKRI-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 | 8pbnGa8uvMF |
|---|---|
| Name | 2,4,6-Trimethylbenzaldehyde |
| 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/c1-7-4-8(2)10(6-11)9(3)5-7/h4-6H,1-3H3 |
| InChIKey | HIKRJHFHGKZKRI-UHFFFAOYSA-N |
| Molecular Weight | 148.205 g/mol |
| SMILES | C=1C(=C(C(=CC1C)C)C=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.966756 |