| SpectraBase Compound ID | Dyd2Q0vHd34 |
|---|---|
| InChI | InChI=1S/C15H26O/c1-13(2)7-10-8-14(10,3)11-5-6-15(4,16)12(11)9-13/h10-12,16H,5-9H2,1-4H3/t10-,11+,12-,14+,15-/m0/s1 |
| InChIKey | LKSYOLUCMPBADN-OEMOEHNSSA-N |
| Mol Weight | 222.37 g/mol |
| Molecular Formula | C15H26O |
| Exact Mass | 222.198365 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9CtPGThWbCh |
|---|---|
| Name | Isolepto-graphiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.198365456 u |
| Formula | C15H26O |
| InChI | InChI=1S/C15H26O/c1-13(2)7-10-8-14(10,3)11-5-6-15(4,16)12(11)9-13/h10-12,16H,5-9H2,1-4H3/t10-,11+,12-,14+,15-/m0/s1 |
| InChIKey | LKSYOLUCMPBADN-OEMOEHNSSA-N |
| Molecular Weight | 222.372 g/mol |
| SMILES | [C@]1(O)([C@@]2([C@@](CC1)([C@]1(C)C[C@@]1(CC(C)(C)C2)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977872 |