| SpectraBase Compound ID | 2vcfn272J9F |
|---|---|
| InChI | InChI=1S/C9H14/c1-3-5-7-9-8-6-4-2/h8-9H,3,5,7H2,1-2H3/b9-8- |
| InChIKey | AIDMRHRNBMILQM-HJWRWDBZSA-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 | 3xEAQU8J6mP |
|---|---|
| Name | 4-Nonen-2-yne, (Z)- |
| 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/c1-3-5-7-9-8-6-4-2/h8-9H,3,5,7H2,1-2H3/b9-8- |
| InChIKey | AIDMRHRNBMILQM-HJWRWDBZSA-N |
| Molecular Weight | 122.211 g/mol |
| SMILES | C(\C=C/C#CC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977135 |