| SpectraBase Compound ID | JF71VLla7jl |
|---|---|
| InChI | InChI=1S/C10H16/c1-10-8-6-4-2-3-5-7-9-10/h4,6,8H,2-3,5,7,9H2,1H3/b6-4-,10-8- |
| InChIKey | IIZOWXGCTRYBPN-GKXDXITGSA-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 | 1nS1MdGcxIM |
|---|---|
| Name | 1,3-Cyclononadiene, 1-methyl- |
| 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/c1-10-8-6-4-2-3-5-7-9-10/h4,6,8H,2-3,5,7,9H2,1H3/b6-4-,10-8- |
| InChIKey | IIZOWXGCTRYBPN-GKXDXITGSA-N |
| Molecular Weight | 136.238 g/mol |
| SMILES | C1\C=C/C=C\(CCCC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93872 |