| SpectraBase Compound ID | IUSxa6Pg020 |
|---|---|
| InChI | InChI=1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h4,6-7H,2-3,5,8H2,1H3/b9-6+ |
| InChIKey | AEWOZSCVKSVBOQ-RMKNXTFCSA-N |
| Mol Weight | 122.21 g/mol |
| Molecular Formula | C9H14 |
| Exact Mass | 122.10955 g/mol |
| SpectraBase Spectrum ID | 72Ok8R96zg3 |
|---|---|
| Name | (3Z)-3-Propylidenecyclohex-1-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.109550451 u |
| Formula | C9H14 |
| InChI | InChI=1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h4,6-7H,2-3,5,8H2,1H3/b9-6+ |
| InChIKey | AEWOZSCVKSVBOQ-RMKNXTFCSA-N |
| Molecular Weight | 122.211 g/mol |
| SMILES | C=1\C(CCCC1)=C/CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951145 |