SpectraBase Compound ID | DfryxC8sYpL |
---|---|
InChI | InChI=1S/C9H16O2/c1-8-7-10-9(11-8)5-3-2-4-6-9/h8H,2-7H2,1H3 |
InChIKey | LKGNKCNAPNUZCM-UHFFFAOYSA-N |
Mol Weight | 156.22 g/mol |
Molecular Formula | C9H16O2 |
Exact Mass | 156.11503 g/mol |
SpectraBase Spectrum ID | BCyp6phNJui |
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Name | 2-Methyl-1,4-dioxaspiro[4.5]decane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 156.115029753 u |
Formula | C9H16O2 |
InChI | InChI=1S/C9H16O2/c1-8-7-10-9(11-8)5-3-2-4-6-9/h8H,2-7H2,1H3 |
InChIKey | LKGNKCNAPNUZCM-UHFFFAOYSA-N |
Molecular Weight | 156.225 g/mol |
SMILES | C1CCCCC11OC(CO1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.911328 |