| SpectraBase Compound ID | DTN5Odxaf0h |
|---|---|
| InChI | InChI=1S/C13H26O/c14-12-13-10-8-6-4-2-1-3-5-7-9-11-13/h13-14H,1-12H2 |
| InChIKey | JQYWAZNRRQRPNN-UHFFFAOYSA-N |
| Mol Weight | 198.35 g/mol |
| Molecular Formula | C13H26O |
| Exact Mass | 198.198365 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | DZPF14Neqlk |
|---|---|
| Name | Cyclododecanemethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.198365456 u |
| Formula | C13H26O |
| InChI | InChI=1S/C13H26O/c14-12-13-10-8-6-4-2-1-3-5-7-9-11-13/h13-14H,1-12H2 |
| InChIKey | JQYWAZNRRQRPNN-UHFFFAOYSA-N |
| Molecular Weight | 198.350 g/mol |
| SMILES | OCC1CCCCCCCCCCC1 |
| Spectrum/Structure Validation Score (Raman) | 0.997797 |