| SpectraBase Compound ID | H8tMPPEDrud |
|---|---|
| InChI | InChI=1S/C16H30/c1-3-14-9-11-16(12-10-14)13(2)15-7-5-4-6-8-15/h13-16H,3-12H2,1-2H3 |
| InChIKey | BHLBNFHYPSEJST-UHFFFAOYSA-N |
| Mol Weight | 222.42 g/mol |
| Molecular Formula | C16H30 |
| Exact Mass | 222.234751 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EME99wrBMO |
|---|---|
| Name | 1-Cyclohexyl-1-(4-ethylcyclohexyl)ethane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.234750966 u |
| Formula | C16H30 |
| InChI | InChI=1S/C16H30/c1-3-14-9-11-16(12-10-14)13(2)15-7-5-4-6-8-15/h13-16H,3-12H2,1-2H3 |
| InChIKey | BHLBNFHYPSEJST-UHFFFAOYSA-N |
| Molecular Weight | 222.416 g/mol |
| SMILES | C1CCC(CC1)C(C)C1CCC(CC)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97306 |