SpectraBase Compound ID | DLeBLBnG8IS |
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InChI | InChI=1S/C10H20O3/c1-5-7-9(11)8(6-2)13-10(3,4)12-7/h7-9,11H,5-6H2,1-4H3 |
InChIKey | DUQICYWXNMENQR-UHFFFAOYSA-N |
Mol Weight | 188.27 g/mol |
Molecular Formula | C10H20O3 |
Exact Mass | 188.141245 g/mol |
SpectraBase Spectrum ID | 2unrEIWV446 |
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Name | 4,6-Diethyl-2,2-dimethyl-1,3-dioxan-5-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 188.141244501 u |
Formula | C10H20O3 |
InChI | InChI=1S/C10H20O3/c1-5-7-9(11)8(6-2)13-10(3,4)12-7/h7-9,11H,5-6H2,1-4H3 |
InChIKey | DUQICYWXNMENQR-UHFFFAOYSA-N |
Molecular Weight | 188.267 g/mol |
SMILES | C1(OC(C(C(O1)CC)O)CC)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944356 |