SpectraBase Compound ID | D7eHtUCyFuM |
---|---|
InChI | InChI=1S/C20H24O2/c1-3-7-17(8-4-1)15-21-19-11-13-20(14-12-19)22-16-18-9-5-2-6-10-18/h1-10,19-20H,11-16H2 |
InChIKey | VPUVXJLDKQPOGL-UHFFFAOYSA-N |
Mol Weight | 296.41 g/mol |
Molecular Formula | C20H24O2 |
Exact Mass | 296.17763 g/mol |
SpectraBase Spectrum ID | L8iiuPDeHGH |
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Name | cis-1,4-di(Benzyloxy)cyclohexane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 296.177630011 u |
Formula | C20H24O2 |
InChI | InChI=1S/C20H24O2/c1-3-7-17(8-4-1)15-21-19-11-13-20(14-12-19)22-16-18-9-5-2-6-10-18/h1-10,19-20H,11-16H2 |
InChIKey | VPUVXJLDKQPOGL-UHFFFAOYSA-N |
SMILES | c1ccc(cc1)COC1CCC(CC1)OCc1ccccc1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.819679 |