SpectraBase Compound ID | 7BuIqDVuXOM |
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InChI | InChI=1S/C14H30O2/c1-2-3-8-11-14(16)12-9-6-4-5-7-10-13-15/h14-16H,2-13H2,1H3 |
InChIKey | HGGLDJDLFALHCP-UHFFFAOYSA-N |
Mol Weight | 230.39 g/mol |
Molecular Formula | C14H30O2 |
Exact Mass | 230.22458 g/mol |
SpectraBase Spectrum ID | BfSd0zksajs |
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Name | Tetradecane-1,9-diol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 230.224580204 u |
Formula | C14H30O2 |
InChI | InChI=1S/C14H30O2/c1-2-3-8-11-14(16)12-9-6-4-5-7-10-13-15/h14-16H,2-13H2,1H3 |
InChIKey | HGGLDJDLFALHCP-UHFFFAOYSA-N |
Molecular Weight | 230.392 g/mol |
SMILES | C(O)(CCCCCCCCO)CCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919249 |