SpectraBase Compound ID | v05fW5Ij9L |
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InChI | InChI=1S/C10H18O/c1-10(2)8-6-4-3-5-7-9-11/h3-4,9-10H,5-8H2,1-2H3/b4-3+ |
InChIKey | JSBADMCZOZKWIH-ONEGZZNKSA-N |
Mol Weight | 154.25 g/mol |
Molecular Formula | C10H18O |
Exact Mass | 154.135765 g/mol |
SpectraBase Spectrum ID | Bs2mSpEkN5o |
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Name | 8-Methylnon-4-enal |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 154.135765199 u |
Formula | C10H18O |
InChI | InChI=1S/C10H18O/c1-10(2)8-6-4-3-5-7-9-11/h3-4,9-10H,5-8H2,1-2H3/b4-3+ |
InChIKey | JSBADMCZOZKWIH-ONEGZZNKSA-N |
Molecular Weight | 154.253 g/mol |
SMILES | C(CC\C=C\CCC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946288 |