| SpectraBase Compound ID | EaW9sgjHhLJ |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-14-7-6-8-15(2)13-17(21)20-18(3,4)16(10-9-14)11-12-19(20,5)22-20/h8-9,16-17,21H,6-7,10-13H2,1-5H3/b14-9+,15-8+/t16-,17?,19-,20+/m0/s1 |
| InChIKey | WFEABYZYKXQZJS-IGPBXKHISA-N |
| Mol Weight | 304.5 g/mol |
| Molecular Formula | C20H32O2 |
| Exact Mass | 304.24023 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KqHCUnXt05P |
|---|---|
| Name | 10-Hydroxyverticillene epoxide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.240230268 u |
| Formula | C20H32O2 |
| InChI | InChI=1S/C20H32O2/c1-14-7-6-8-15(2)13-17(21)20-18(3,4)16(10-9-14)11-12-19(20,5)22-20/h8-9,16-17,21H,6-7,10-13H2,1-5H3/b14-9+,15-8+/t16-,17?,19-,20+/m0/s1 |
| InChIKey | WFEABYZYKXQZJS-IGPBXKHISA-N |
| Molecular Weight | 304.474 g/mol |
| SMILES | [C@@]123[C@@](CC[C@@](C3(C)C)(C\C=C/(C)CC\C=C\(CC1O)C)[H])(C)O2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968593 |