| SpectraBase Compound ID | 4z6lNr62RVN |
|---|---|
| InChI | InChI=1S/C9H14/c1-9-7-5-3-2-4-6-8-9/h2-3,8H,4-7H2,1H3/b3-2-,9-8- |
| InChIKey | HOEFIGOFJSMARD-FUOWLQLWSA-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 | CYD91WdHhup |
|---|---|
| Name | (1Z,5Z)-1-Methylcycloocta-1,5-diene |
| 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/c1-9-7-5-3-2-4-6-8-9/h2-3,8H,4-7H2,1H3/b3-2-,9-8- |
| InChIKey | HOEFIGOFJSMARD-FUOWLQLWSA-N |
| Molecular Weight | 122.211 g/mol |
| SMILES | C1\C=C/(CC\C=C/C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.982636 |