SpectraBase Compound ID | 3K5Ea0ykppp |
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InChI | InChI=1S/C12H20O2/c1-10-5-7-11(8-6-10)14-12-4-2-3-9-13-12/h11-12H,1-9H2 |
InChIKey | LOHAOAJJOLPQBV-UHFFFAOYSA-N |
Mol Weight | 196.29 g/mol |
Molecular Formula | C12H20O2 |
Exact Mass | 196.14633 g/mol |
SpectraBase Spectrum ID | A0qY68naSts |
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Name | 4-Methylene-1-(tetrahydropyran-2-yloxy)cyclohexane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.146329882 u |
Formula | C12H20O2 |
InChI | InChI=1S/C12H20O2/c1-10-5-7-11(8-6-10)14-12-4-2-3-9-13-12/h11-12H,1-9H2 |
InChIKey | LOHAOAJJOLPQBV-UHFFFAOYSA-N |
Molecular Weight | 196.290 g/mol |
SMILES | C1(=C)CCC(OC2OCCCC2)CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.805391 |