| SpectraBase Compound ID | 6MawiTmoMOM |
|---|---|
| InChI | InChI=1S/C12H24O3/c13-9-5-2-1-3-6-10-14-12-8-4-7-11-15-12/h12-13H,1-11H2 |
| InChIKey | FFJDLFLMOAJWAY-UHFFFAOYSA-N |
| Mol Weight | 216.32 g/mol |
| Molecular Formula | C12H24O3 |
| Exact Mass | 216.172545 g/mol |
| SpectraBase Spectrum ID | 9T1ZAFjGB01 |
|---|---|
| Name | 7-(Tetrahydro-2H-pyran-2-yloxy)-1-heptanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.172544630 u |
| Formula | C12H24O3 |
| InChI | InChI=1S/C12H24O3/c13-9-5-2-1-3-6-10-14-12-8-4-7-11-15-12/h12-13H,1-11H2 |
| InChIKey | FFJDLFLMOAJWAY-UHFFFAOYSA-N |
| Molecular Weight | 216.321 g/mol |
| SMILES | C(CCCCCCOC1CCCCO1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.931673 |