| SpectraBase Compound ID | LTiIjgfHWAb |
|---|---|
| InChI | InChI=1S/2C12H20O2/c2*13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h2*1-10H2 |
| InChIKey | KEYBFYXKHFADTR-UHFFFAOYSA-N |
| Mol Weight | 392.58 g/mol |
| Molecular Formula | C24H40O4 |
| Exact Mass | 392.29266 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | B7e6dvMTLBU |
|---|---|
| Name | 1,2-Cyclododecanedione, dimer |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.292659764 u |
| Formula | C24H40O4 |
| InChI | InChI=1S/2C12H20O2/c2*13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h2*1-10H2 |
| InChIKey | KEYBFYXKHFADTR-UHFFFAOYSA-N |
| Molecular Weight | 392.580 g/mol |
| SMILES | C1CC(C(CCCCCCCC1)=O)=O.C1CC(C(CCCCCCCC1)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.979834 |