| SpectraBase Compound ID | 1QMUMxSlobp |
|---|---|
| InChI | InChI=1S/C8H18N2O2/c1-5-11-7-3-10-4-8-12-6-2-9-1/h9-10H,1-8H2 |
| InChIKey | PWJHXHMUGFXPSN-UHFFFAOYSA-N |
| Mol Weight | 174.24 g/mol |
| Molecular Formula | C8H18N2O2 |
| Exact Mass | 174.136828 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ZPsqPQ8DND |
|---|---|
| Name | 1,7-Dioxa-4,10-diazacyclododecane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.136827826 u |
| Formula | C8H18N2O2 |
| InChI | InChI=1S/C8H18N2O2/c1-5-11-7-3-10-4-8-12-6-2-9-1/h9-10H,1-8H2 |
| InChIKey | PWJHXHMUGFXPSN-UHFFFAOYSA-N |
| Molecular Weight | 174.244 g/mol |
| SMILES | C1NCCOCCNCCOC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.807142 |