| SpectraBase Compound ID | Kvml6z5yfy |
|---|---|
| InChI | InChI=1S/C16H28O/c17-14-15(8-3-1-4-9-15)12-7-13-16(14)10-5-2-6-11-16/h14,17H,1-13H2 |
| InChIKey | YIFATUJCSRHWBJ-UHFFFAOYSA-N |
| Mol Weight | 236.4 g/mol |
| Molecular Formula | C16H28O |
| Exact Mass | 236.214016 g/mol |
| SpectraBase Spectrum ID | FspoRWEMDZ9 |
|---|---|
| Name | Dispiro[5.1.5.3]hexadecan-7-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.214015521 u |
| Formula | C16H28O |
| InChI | InChI=1S/C16H28O/c17-14-15(8-3-1-4-9-15)12-7-13-16(14)10-5-2-6-11-16/h14,17H,1-13H2 |
| InChIKey | YIFATUJCSRHWBJ-UHFFFAOYSA-N |
| Molecular Weight | 236.399 g/mol |
| SMILES | OC1C2(CCCCC2)CCCC11CCCCC1 |
| Spectrum/Structure Validation Score (Raman) | 0.979489 |