| SpectraBase Compound ID | BBiDE0cy2JD |
|---|---|
| InChI | InChI=1S/C8H12O2/c9-5-7-1-2-8(6-10)4-3-7/h5-8H,1-4H2 |
| InChIKey | QWKLKVRIQGSSKF-UHFFFAOYSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 42FgxMgDRcR |
|---|---|
| Name | Cyclohexane-1,4-dicarbaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.083729624 u |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c9-5-7-1-2-8(6-10)4-3-7/h5-8H,1-4H2 |
| InChIKey | QWKLKVRIQGSSKF-UHFFFAOYSA-N |
| SMILES | C(=O)C1CCC(C=O)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940722 |