| SpectraBase Compound ID | 9tvgHrCzOJD |
|---|---|
| InChI | InChI=1S/C12H26O7/c13-1-3-15-5-7-17-9-11-19-12-10-18-8-6-16-4-2-14/h13-14H,1-12H2 |
| InChIKey | IIRDTKBZINWQAW-UHFFFAOYSA-N |
| Mol Weight | 282.33 g/mol |
| Molecular Formula | C12H26O7 |
| Exact Mass | 282.167853 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4C4wtfP1Z0V |
|---|---|
| Name | Hexaethylene glycol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.167853170 u |
| Formula | C12H26O7 |
| InChI | InChI=1S/C12H26O7/c13-1-3-15-5-7-17-9-11-19-12-10-18-8-6-16-4-2-14/h13-14H,1-12H2 |
| InChIKey | IIRDTKBZINWQAW-UHFFFAOYSA-N |
| Molecular Weight | 282.333 g/mol |
| SMILES | C(COCCOCCOCCOCCOCCO)O |
| Spectrum/Structure Validation Score (Raman) | 0.990384 |