SpectraBase Compound ID | Hm5C9TnEiuO |
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InChI | InChI=1S/C9H14/c1-2-4-6-8-9-7-5-3-1/h1-4H,5-9H2/b3-1-,4-2- |
InChIKey | HVSYSQGJZITGQV-CCAGOZQPSA-N |
Mol Weight | 122.21 g/mol |
Molecular Formula | C9H14 |
Exact Mass | 122.10955 g/mol |
SpectraBase Spectrum ID | HdwYmxaGq9p |
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Name | (1Z,3Z)-Cyclonona-1,3-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/c1-2-4-6-8-9-7-5-3-1/h1-4H,5-9H2/b3-1-,4-2- |
InChIKey | HVSYSQGJZITGQV-CCAGOZQPSA-N |
Molecular Weight | 122.211 g/mol |
SMILES | C1\C=C/C=C\CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964171 |