SpectraBase Compound ID | 8Onb8sGCHJ6 |
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InChI | InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h8-9H,3-7,10-13H2,1-2H3/b9-8- |
InChIKey | FOEWNRTZASNZJY-HJWRWDBZSA-N |
Mol Weight | 226.36 g/mol |
Molecular Formula | C14H26O2 |
Exact Mass | 226.19328 g/mol |
SpectraBase Spectrum ID | 86K85e7Cxpm |
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Name | 5-Dodecen-1-ol, acetate, (Z)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 226.193280075 u |
Formula | C14H26O2 |
InChI | InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h8-9H,3-7,10-13H2,1-2H3/b9-8- |
InChIKey | FOEWNRTZASNZJY-HJWRWDBZSA-N |
Molecular Weight | 226.360 g/mol |
SMILES | C(\C=C/CCCCCC)CCCOC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.863819 |