| SpectraBase Compound ID | FShrYCuE3mb |
|---|---|
| InChI | InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15+/m0/s1 |
| InChIKey | LHYHMMRYTDARSZ-ZQDZILKHSA-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 | IkFLX7qEsZR |
|---|---|
| Name | (+/-)-torreyol |
| 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/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15+/m0/s1 |
| InChIKey | LHYHMMRYTDARSZ-ZQDZILKHSA-N |
| Molecular Weight | 222.372 g/mol |
| SMILES | [C@@]1(O)([C@@]2([C@@](C=C(CC2)C)([C@@](CC1)(C(C)C)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920928 |