| SpectraBase Compound ID | 48kKXn3MVOK |
|---|---|
| InChI | InChI=1S/C13H14O/c1-13(2,14)12-9-5-7-10-6-3-4-8-11(10)12/h3-9,14H,1-2H3 |
| InChIKey | IBENYRAUOZMVRG-UHFFFAOYSA-N |
| Mol Weight | 186.25 g/mol |
| Molecular Formula | C13H14O |
| Exact Mass | 186.104465 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FOhXaBe0BJP |
|---|---|
| Name | alpha,alpha-Dimethyl-1-naphthalenemethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.104465070 u |
| Formula | C13H14O |
| InChI | InChI=1S/C13H14O/c1-13(2,14)12-9-5-7-10-6-3-4-8-11(10)12/h3-9,14H,1-2H3 |
| InChIKey | IBENYRAUOZMVRG-UHFFFAOYSA-N |
| Molecular Weight | 186.254 g/mol |
| SMILES | OC(C1=CC=CC=2C=CC=CC12)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.890551 |