| SpectraBase Compound ID | 6Rp2XaRkj2F |
|---|---|
| InChI | InChI=1S/C13H24O/c14-12-13-10-8-6-4-2-1-3-5-7-9-11-13/h12-13H,1-11H2 |
| InChIKey | KIYUNVUWDQKWPJ-UHFFFAOYSA-N |
| Mol Weight | 196.33 g/mol |
| Molecular Formula | C13H24O |
| Exact Mass | 196.182715 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8KDNfKQ2AwB |
|---|---|
| Name | Cyclododecanecarboxaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.182715392 u |
| Formula | C13H24O |
| InChI | InChI=1S/C13H24O/c14-12-13-10-8-6-4-2-1-3-5-7-9-11-13/h12-13H,1-11H2 |
| InChIKey | KIYUNVUWDQKWPJ-UHFFFAOYSA-N |
| Molecular Weight | 196.334 g/mol |
| SMILES | C1(CCCCCCCCCCC1)C=O |
| Spectrum/Structure Validation Score (Raman) | 0.996513 |