| SpectraBase Compound ID | D5GarzUiHoU |
|---|---|
| InChI | InChI=1S/C11H12O2/c1-7-5-8-3-4-10(12)9(8)6-11(7)13-2/h5-6H,3-4H2,1-2H3 |
| InChIKey | WVQJXNUKXLFZKT-UHFFFAOYSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C11H12O2 |
| Exact Mass | 176.08373 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5mhZYD0kgm |
|---|---|
| Name | 6-Methoxy-5-methyl-1-indanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.083729624 u |
| Formula | C11H12O2 |
| InChI | InChI=1S/C11H12O2/c1-7-5-8-3-4-10(12)9(8)6-11(7)13-2/h5-6H,3-4H2,1-2H3 |
| InChIKey | WVQJXNUKXLFZKT-UHFFFAOYSA-N |
| Molecular Weight | 176.215 g/mol |
| SMILES | C1(=O)C2=C(C=C(C)C(=C2)OC)CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.99166 |