| SpectraBase Compound ID | 27vZxSY5Z85 |
|---|---|
| InChI | InChI=1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h6,9H,1,3-5,7-8H2 |
| InChIKey | CQHBBSICMXUMIB-UHFFFAOYSA-N |
| Mol Weight | 122.21 g/mol |
| Molecular Formula | C9H14 |
| Exact Mass | 122.10955 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BKNmskfB8Gs |
|---|---|
| Name | 1-Cyclohexyl-1,2-propadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 123.117375483 u |
| Formula | C9H15 |
| InChI | InChI=1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h6,9H,1,3-5,7-8H2 |
| InChIKey | CQHBBSICMXUMIB-UHFFFAOYSA-N |
| Molecular Weight | 123.219 g/mol |
| Nominal Mass | 123 u |
| SMILES | [CH3]=C=CC1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935216 |