| SpectraBase Compound ID | 3uq7mMP3OvQ |
|---|---|
| InChI | InChI=1S/C11H14O/c1-9(2)8-10-4-6-11(12-3)7-5-10/h4-8H,1-3H3 |
| InChIKey | QABCSPDGWHIRHC-UHFFFAOYSA-N |
| Mol Weight | 162.23 g/mol |
| Molecular Formula | C11H14O |
| Exact Mass | 162.104465 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4skULjyNz19 |
|---|---|
| Name | 1-Methoxy-4-(2-methylpropenyl)-benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.104465070 u |
| Formula | C11H14O |
| InChI | InChI=1S/C11H14O/c1-9(2)8-10-4-6-11(12-3)7-5-10/h4-8H,1-3H3 |
| InChIKey | QABCSPDGWHIRHC-UHFFFAOYSA-N |
| Molecular Weight | 162.232 g/mol |
| SMILES | COC1=CC=C(C=C1)C=C(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.957213 |