SpectraBase Compound ID | KDdl9jRp0aP |
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InChI | InChI=1S/C10H16/c1-9-5-3-4-6-10(2)8-7-9/h5-6H,3-4,7-8H2,1-2H3/b9-5-,10-6- |
InChIKey | UKNFYLAGXMXTKA-OZDSWYPASA-N |
Mol Weight | 136.24 g/mol |
Molecular Formula | C10H16 |
Exact Mass | 136.125201 g/mol |
SpectraBase Spectrum ID | 65FF0tsPPOc |
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Name | 1,5-Cyclooctadiene, 1,6-dimethyl- |
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/c1-9-5-3-4-6-10(2)8-7-9/h5-6H,3-4,7-8H2,1-2H3/b9-5-,10-6- |
InChIKey | UKNFYLAGXMXTKA-OZDSWYPASA-N |
Molecular Weight | 136.238 g/mol |
SMILES | C\C=1CC\C(C)=C/CCC/1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915394 |