| SpectraBase Compound ID | 27o8xAWXnMM |
|---|---|
| InChI | InChI=1S/C9H12O2/c1-7-4-5-8(10-2)6-9(7)11-3/h4-6H,1-3H3 |
| InChIKey | OSNMRWURXNWCGA-UHFFFAOYSA-N |
| Mol Weight | 152.19 g/mol |
| Molecular Formula | C9H12O2 |
| Exact Mass | 152.08373 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FNgvDPs9Kcd |
|---|---|
| Name | Benzene, 1,3-dimethoxy-4-methyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.083729624 u |
| Formula | C9H12O2 |
| InChI | InChI=1S/C9H12O2/c1-7-4-5-8(10-2)6-9(7)11-3/h4-6H,1-3H3 |
| InChIKey | OSNMRWURXNWCGA-UHFFFAOYSA-N |
| Molecular Weight | 152.193 g/mol |
| SMILES | C=1(OC)C=C(C=CC1C)OC |
| Spectrum/Structure Validation Score (Raman) | 0.968574 |