| SpectraBase Compound ID | 4B47oHkBwei |
|---|---|
| InChI | InChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3,5,7,9H,4,6,8H2,1-2H3/b5-3+,9-7+ |
| InChIKey | HKEBYUNPANBGPL-WJDMQLPWSA-N |
| Mol Weight | 124.23 g/mol |
| Molecular Formula | C9H16 |
| Exact Mass | 124.125201 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BDVRWjGcJWK |
|---|---|
| Name | 2,4-Nonadiene, (E,E)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 124.125200515 u |
| Formula | C9H16 |
| InChI | InChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3,5,7,9H,4,6,8H2,1-2H3/b5-3+,9-7+ |
| InChIKey | HKEBYUNPANBGPL-WJDMQLPWSA-N |
| Molecular Weight | 124.227 g/mol |
| SMILES | C(\C=C\C=C\C)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96993 |