| SpectraBase Compound ID | FhYEgUVWrbf |
|---|---|
| InChI | InChI=1S/C10H16/c1-3-10(4-2)8-6-5-7-9-10/h5-8H,3-4,9H2,1-2H3 |
| InChIKey | GIQRNTXKSRNKTR-UHFFFAOYSA-N |
| Mol Weight | 136.24 g/mol |
| Molecular Formula | C10H16 |
| Exact Mass | 136.125201 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5K9X1XQMr1m |
|---|---|
| Name | 1,3-Cyclohexadiene, 5,5-diethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.125200515 u |
| Formula | C10H16 |
| InChI | InChI=1S/C10H16/c1-3-10(4-2)8-6-5-7-9-10/h5-8H,3-4,9H2,1-2H3 |
| InChIKey | GIQRNTXKSRNKTR-UHFFFAOYSA-N |
| Molecular Weight | 136.238 g/mol |
| SMILES | C1(C=CC=CC1)(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957803 |