| SpectraBase Compound ID | BQlhLOgH6y7 |
|---|---|
| InChI | InChI=1S/C18H30O/c1-2-3-4-5-6-7-8-9-10-11-13-17-14-12-15-18(19)16-17/h12,14-16,19H,2-11,13H2,1H3 |
| InChIKey | PPUYTKKLEAZCCW-UHFFFAOYSA-N |
| Mol Weight | 262.44 g/mol |
| Molecular Formula | C18H30O |
| Exact Mass | 262.229666 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | CwL1TsqZOFP |
|---|---|
| Name | m-Dodecylphenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.229665585 u |
| Formula | C18H30O |
| InChI | InChI=1S/C18H30O/c1-2-3-4-5-6-7-8-9-10-11-13-17-14-12-15-18(19)16-17/h12,14-16,19H,2-11,13H2,1H3 |
| InChIKey | PPUYTKKLEAZCCW-UHFFFAOYSA-N |
| Molecular Weight | 262.437 g/mol |
| SMILES | OC1=CC(=CC=C1)CCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Raman) | 0.989791 |