| SpectraBase Compound ID | A0j2SkLOB5J |
|---|---|
| InChI | InChI=1S/C8H18O2/c1-4-6-9-7-10-8(3)5-2/h8H,4-7H2,1-3H3 |
| InChIKey | NPFCLWSPJBPJHY-UHFFFAOYSA-N |
| Mol Weight | 146.23 g/mol |
| Molecular Formula | C8H18O2 |
| Exact Mass | 146.13068 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Fp0UGlLoKmR |
|---|---|
| Name | 3-Methyl-4,6-dioxanonane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.130679818 u |
| Formula | C8H18O2 |
| InChI | InChI=1S/C8H18O2/c1-4-6-9-7-10-8(3)5-2/h8H,4-7H2,1-3H3 |
| InChIKey | NPFCLWSPJBPJHY-UHFFFAOYSA-N |
| Molecular Weight | 146.230 g/mol |
| SMILES | CCC(OCOCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962649 |