| SpectraBase Compound ID | IKndqLF5GNF |
|---|---|
| InChI | InChI=1S/C15H26O2/c1-10(2)11-5-7-14(3,16)12-6-8-15(4,17)13(12)9-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15+/m1/s1 |
| InChIKey | RQHOQQOEZPFYTD-QTVXIADOSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C15H26O2 |
| Exact Mass | 238.19328 g/mol |
| SpectraBase Spectrum ID | GGEIQc9OlOG |
|---|---|
| Name | Guaidiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.193280075 u |
| Formula | C15H26O2 |
| InChI | InChI=1S/C15H26O2/c1-10(2)11-5-7-14(3,16)12-6-8-15(4,17)13(12)9-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15+/m1/s1 |
| InChIKey | RQHOQQOEZPFYTD-QTVXIADOSA-N |
| Molecular Weight | 238.371 g/mol |
| SMILES | [C@]1(O)([C@]2(CC[C@@]([C@]2(C[C@@](CC1)(C(C)=C)[H])[H])(O)C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935082 |