| SpectraBase Compound ID | FipQ2D4hB7J |
|---|---|
| InChI | InChI=1S/C10H14O/c1-3-8-5-9(4-2)7-10(11)6-8/h5-7,11H,3-4H2,1-2H3 |
| InChIKey | LPCJHUPMQKSPDC-UHFFFAOYSA-N |
| Mol Weight | 150.22 g/mol |
| Molecular Formula | C10H14O |
| Exact Mass | 150.104465 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1tWwggqAQBf |
|---|---|
| Name | 3,5-Diethylphenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.104465070 u |
| Formula | C10H14O |
| InChI | InChI=1S/C10H14O/c1-3-8-5-9(4-2)7-10(11)6-8/h5-7,11H,3-4H2,1-2H3 |
| InChIKey | LPCJHUPMQKSPDC-UHFFFAOYSA-N |
| Molecular Weight | 150.221 g/mol |
| SMILES | OC1=CC(=CC(=C1)CC)CC |
| Spectrum/Structure Validation Score (Raman) | 0.982401 |