| SpectraBase Compound ID | 7iYYqQ2r2IH |
|---|---|
| InChI | InChI=1S/C11H22/c1-4-10-8-6-7-9(3)11(10)5-2/h9-11H,4-8H2,1-3H3 |
| InChIKey | DGTVJPPECBACBB-UHFFFAOYSA-N |
| Mol Weight | 154.3 g/mol |
| Molecular Formula | C11H22 |
| Exact Mass | 154.172151 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | InIjugdWTOJ |
|---|---|
| Name | Cyclohexane, 1,2-diethyl-3-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.172150708 u |
| Formula | C11H22 |
| InChI | InChI=1S/C11H22/c1-4-10-8-6-7-9(3)11(10)5-2/h9-11H,4-8H2,1-3H3 |
| InChIKey | DGTVJPPECBACBB-UHFFFAOYSA-N |
| Molecular Weight | 154.297 g/mol |
| SMILES | C(C)C1C(CC)C(C)CCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87221 |